data_nef_c17477_2l9l save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 7 CYS SG 1 162 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -5 MET start . . 2 A -4 LYS middle . . 3 A -3 SER middle . . 4 A -2 GLY middle . false 5 A -1 HIS middle . . 6 A 0 GLY middle . false 7 A 1 CYS middle -HG . 8 A 2 SER middle . . 9 A 3 GLU middle . . 10 A 4 PRO middle . false 11 A 5 LEU middle . . 12 A 6 GLY middle . false 13 A 7 LEU middle . . 14 A 8 LYS middle . . 15 A 9 ASN middle . . 16 A 10 ASN middle . . 17 A 11 THR middle . . 18 A 12 ILE middle . . 19 A 13 PRO middle . false 20 A 14 ASP middle . . 21 A 15 SER middle . . 22 A 16 GLN middle . . 23 A 17 MET middle . . 24 A 18 SER middle . . 25 A 19 ALA middle . . 26 A 20 SER middle . . 27 A 21 SER middle . . 28 A 22 SER middle . . 29 A 23 TYR middle . . 30 A 24 LYS middle . . 31 A 25 THR middle . . 32 A 26 TRP middle . . 33 A 27 ASN middle . . 34 A 28 LEU middle . . 35 A 29 ARG middle . . 36 A 30 ALA middle . . 37 A 31 PHE middle . . 38 A 32 GLY middle . false 39 A 33 TRP middle . . 40 A 34 TYR middle . . 41 A 35 PRO middle . false 42 A 36 HIS middle . . 43 A 37 LEU middle . . 44 A 38 GLY middle . false 45 A 39 ARG middle . . 46 A 40 LEU middle . . 47 A 41 ASP middle . . 48 A 42 ASN middle . . 49 A 43 GLN middle . . 50 A 44 GLY middle . false 51 A 45 LYS middle . . 52 A 46 ILE middle . . 53 A 47 ASN middle . . 54 A 48 ALA middle . . 55 A 49 TRP middle . . 56 A 50 THR middle . . 57 A 51 ALA middle . . 58 A 52 GLN middle . . 59 A 53 SER middle . . 60 A 54 ASN middle . . 61 A 55 SER middle . . 62 A 56 ALA middle . . 63 A 57 LYS middle . . 64 A 58 GLU middle . . 65 A 59 TRP middle . . 66 A 60 LEU middle . . 67 A 61 GLN middle . . 68 A 62 VAL middle . . 69 A 63 ASP middle . . 70 A 64 LEU middle . . 71 A 65 GLY middle . false 72 A 66 THR middle . . 73 A 67 GLN middle . . 74 A 68 ARG middle . . 75 A 69 GLN middle . . 76 A 70 VAL middle . . 77 A 71 THR middle . . 78 A 72 GLY middle . false 79 A 73 ILE middle . . 80 A 74 ILE middle . . 81 A 75 THR middle . . 82 A 76 GLN middle . . 83 A 77 GLY middle . false 84 A 78 ALA middle . . 85 A 79 ARG middle . . 86 A 80 ASP middle . . 87 A 81 PHE middle . . 88 A 82 GLY middle . false 89 A 83 HIS middle . . 90 A 84 ILE middle . . 91 A 85 GLN middle . . 92 A 86 TYR middle . . 93 A 87 VAL middle . . 94 A 88 ALA middle . . 95 A 89 SER middle . . 96 A 90 TYR middle . . 97 A 91 LYS middle . . 98 A 92 VAL middle . . 99 A 93 ALA middle . . 100 A 94 HIS middle . . 101 A 95 SER middle . . 102 A 96 ASP middle . . 103 A 97 ASP middle . . 104 A 98 GLY middle . false 105 A 99 VAL middle . . 106 A 100 GLN middle . . 107 A 101 TRP middle . . 108 A 102 THR middle . . 109 A 103 VAL middle . . 110 A 104 TYR middle . . 111 A 105 GLU middle . . 112 A 106 GLU middle . . 113 A 107 GLN middle . . 114 A 108 GLY middle . false 115 A 109 SER middle . . 116 A 110 SER middle . . 117 A 111 LYS middle . . 118 A 112 VAL middle . . 119 A 113 PHE middle . . 120 A 114 GLN middle . . 121 A 115 GLY middle . false 122 A 116 ASN middle . . 123 A 117 LEU middle . . 124 A 118 ASP middle . . 125 A 119 ASN middle . . 126 A 120 ASN middle . . 127 A 121 SER middle . . 128 A 122 HIS middle . . 129 A 123 LYS middle . . 130 A 124 LYS middle . . 131 A 125 ASN middle . . 132 A 126 ILE middle . . 133 A 127 PHE middle . . 134 A 128 GLU middle . . 135 A 129 LYS middle . . 136 A 130 PRO middle . false 137 A 131 PHE middle . . 138 A 132 MET middle . . 139 A 133 ALA middle . . 140 A 134 ARG middle . . 141 A 135 TYR middle . . 142 A 136 VAL middle . . 143 A 137 ARG middle . . 144 A 138 VAL middle . . 145 A 139 LEU middle . . 146 A 140 PRO middle . false 147 A 141 VAL middle . . 148 A 142 SER middle . . 149 A 143 TRP middle . . 150 A 144 HIS middle . . 151 A 145 ASN middle . . 152 A 146 ARG middle . . 153 A 147 ILE middle . . 154 A 148 THR middle . . 155 A 149 LEU middle . . 156 A 150 ARG middle . . 157 A 151 LEU middle . . 158 A 152 GLU middle . . 159 A 153 LEU middle . . 160 A 154 LEU middle . . 161 A 155 GLY middle . false 162 A 156 CYS middle -HG . 163 A 157 LEU middle . . 164 A 158 GLU middle . . 165 A 159 HIS middle . . 166 A 160 HIS middle . . 167 A 161 HIS middle . . 168 A 162 HIS middle . . 169 A 163 HIS middle . . 170 A 164 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A -3 SER HA H 1 4.340 0.020 A -3 SER HBx H 1 3.730 0.020 A -3 SER HBy H 1 3.730 0.020 A -3 SER C C 13 172.158 0.400 A -3 SER CA C 13 55.596 0.400 A -3 SER CB C 13 61.140 0.400 A -2 GLY H H 1 8.419 0.020 A -2 GLY HAx H 1 3.830 0.020 A -2 GLY HAy H 1 3.830 0.020 A -2 GLY C C 13 171.344 0.400 A -2 GLY CA C 13 42.540 0.400 A -2 GLY N N 15 110.700 0.400 A -1 HIS H H 1 8.310 0.020 A -1 HIS HA H 1 4.496 0.020 A -1 HIS HBy H 1 3.044 0.020 A -1 HIS HBx H 1 2.950 0.020 A -1 HIS C C 13 173.122 0.400 A -1 HIS CA C 13 53.449 0.400 A -1 HIS CB C 13 27.900 0.400 A -1 HIS N N 15 118.750 0.400 A 0 GLY H H 1 8.414 0.020 A 0 GLY HAx H 1 3.830 0.020 A 0 GLY HAy H 1 3.830 0.020 A 0 GLY C C 13 171.322 0.400 A 0 GLY CA C 13 42.572 0.400 A 0 GLY N N 15 110.625 0.400 A 1 CYS H H 1 8.322 0.020 A 1 CYS HA H 1 4.569 0.020 A 1 CYS HBx H 1 3.211 0.020 A 1 CYS HBy H 1 3.211 0.020 A 1 CYS C C 13 171.313 0.400 A 1 CYS CA C 13 53.315 0.400 A 1 CYS CB C 13 42.748 0.400 A 1 CYS N N 15 118.533 0.400 A 2 SER H H 1 8.726 0.020 A 2 SER HA H 1 4.120 0.020 A 2 SER HBx H 1 3.547 0.020 A 2 SER HBy H 1 3.547 0.020 A 2 SER C C 13 170.189 0.400 A 2 SER CA C 13 54.031 0.400 A 2 SER CB C 13 60.184 0.400 A 2 SER N N 15 118.750 0.400 A 3 GLU H H 1 8.372 0.020 A 3 GLU HA H 1 4.389 0.020 A 3 GLU HBy H 1 2.226 0.020 A 3 GLU HBx H 1 2.109 0.020 A 3 GLU HGy H 1 1.922 0.020 A 3 GLU HGx H 1 1.860 0.020 A 3 GLU CA C 13 50.860 0.400 A 3 GLU CB C 13 27.660 0.400 A 3 GLU CG C 13 33.372 0.400 A 3 GLU N N 15 122.438 0.400 A 4 PRO HA H 1 4.560 0.020 A 4 PRO HBy H 1 2.168 0.020 A 4 PRO HBx H 1 2.087 0.020 A 4 PRO HDy H 1 3.621 0.020 A 4 PRO HDx H 1 3.588 0.020 A 4 PRO HGy H 1 1.903 0.020 A 4 PRO HGx H 1 1.736 0.020 A 4 PRO C C 13 175.797 0.400 A 4 PRO CA C 13 59.984 0.400 A 4 PRO CB C 13 30.041 0.400 A 4 PRO CD C 13 48.998 0.400 A 4 PRO CG C 13 29.967 0.400 A 5 LEU H H 1 8.798 0.020 A 5 LEU HA H 1 4.169 0.020 A 5 LEU HBy H 1 1.507 0.020 A 5 LEU HBx H 1 1.350 0.020 A 5 LEU HDx% H 1 0.634 0.020 A 5 LEU HDy% H 1 0.501 0.020 A 5 LEU HG H 1 1.350 0.020 A 5 LEU C C 13 173.756 0.400 A 5 LEU CA C 13 52.713 0.400 A 5 LEU CB C 13 39.091 0.400 A 5 LEU CD1 C 13 23.843 0.400 A 5 LEU CD2 C 13 23.843 0.400 A 5 LEU CG C 13 30.064 0.400 A 5 LEU N N 15 121.877 0.400 A 6 GLY H H 1 7.048 0.020 A 6 GLY HAy H 1 4.541 0.020 A 6 GLY HAx H 1 4.088 0.020 A 6 GLY C C 13 172.634 0.400 A 6 GLY CA C 13 43.997 0.400 A 6 GLY N N 15 102.751 0.400 A 7 LEU H H 1 9.924 0.020 A 7 LEU HA H 1 4.287 0.020 A 7 LEU HBy H 1 2.375 0.020 A 7 LEU HBx H 1 1.379 0.020 A 7 LEU HDx% H 1 0.901 0.020 A 7 LEU HDy% H 1 0.906 0.020 A 7 LEU HG H 1 1.682 0.020 A 7 LEU C C 13 177.327 0.400 A 7 LEU CA C 13 54.623 0.400 A 7 LEU CB C 13 37.747 0.400 A 7 LEU CD1 C 13 23.371 0.400 A 7 LEU CD2 C 13 22.746 0.400 A 7 LEU CG C 13 25.841 0.400 A 7 LEU N N 15 124.313 0.400 A 8 LYS H H 1 9.345 0.020 A 8 LYS HA H 1 3.884 0.020 A 8 LYS HBy H 1 1.871 0.020 A 8 LYS HBx H 1 1.789 0.020 A 8 LYS C C 13 175.020 0.400 A 8 LYS CA C 13 57.131 0.400 A 8 LYS CB C 13 30.178 0.400 A 8 LYS CD C 13 30.371 0.400 A 8 LYS CE C 13 39.277 0.400 A 8 LYS CG C 13 22.095 0.400 A 8 LYS N N 15 122.116 0.400 A 9 ASN H H 1 8.443 0.020 A 9 ASN HA H 1 4.491 0.020 A 9 ASN HBy H 1 3.153 0.020 A 9 ASN HBx H 1 2.587 0.020 A 9 ASN HD2y H 1 7.302 0.020 A 9 ASN HD2x H 1 6.685 0.020 A 9 ASN C C 13 172.704 0.400 A 9 ASN CA C 13 48.998 0.400 A 9 ASN CB C 13 34.622 0.400 A 9 ASN N N 15 112.751 0.400 A 9 ASN ND2 N 15 112.269 0.400 A 10 ASN H H 1 7.294 0.020 A 10 ASN HA H 1 4.188 0.020 A 10 ASN HBy H 1 2.910 0.020 A 10 ASN HBx H 1 2.861 0.020 A 10 ASN HD2x H 1 6.944 0.020 A 10 ASN HD2y H 1 7.355 0.020 A 10 ASN C C 13 171.562 0.400 A 10 ASN CA C 13 49.103 0.400 A 10 ASN CB C 13 34.622 0.400 A 10 ASN N N 15 109.313 0.400 A 10 ASN ND2 N 15 109.692 0.400 A 11 THR H H 1 8.265 0.020 A 11 THR HA H 1 4.084 0.020 A 11 THR HB H 1 4.189 0.020 A 11 THR HG2% H 1 1.096 0.020 A 11 THR C C 13 174.861 0.400 A 11 THR CA C 13 62.123 0.400 A 11 THR CB C 13 66.498 0.400 A 11 THR CG2 C 13 18.996 0.400 A 11 THR N N 15 112.438 0.400 A 12 ILE H H 1 7.719 0.020 A 12 ILE HA H 1 4.187 0.020 A 12 ILE HB H 1 1.785 0.020 A 12 ILE HD1% H 1 0.583 0.020 A 12 ILE HG1x H 1 1.252 0.020 A 12 ILE HG1y H 1 1.252 0.020 A 12 ILE HG2% H 1 0.747 0.020 A 12 ILE CA C 13 54.910 0.400 A 12 ILE CB C 13 34.970 0.400 A 12 ILE N N 15 124.313 0.400 A 13 PRO HA H 1 4.488 0.020 A 13 PRO HBx H 1 2.236 0.020 A 13 PRO HBy H 1 2.236 0.020 A 13 PRO HDx H 1 3.724 0.020 A 13 PRO HDy H 1 3.724 0.020 A 13 PRO HGx H 1 1.953 0.020 A 13 PRO HGy H 1 1.953 0.020 A 13 PRO C C 13 174.187 0.400 A 13 PRO CA C 13 59.682 0.400 A 13 PRO CB C 13 30.300 0.400 A 13 PRO CD C 13 48.806 0.400 A 13 PRO CG C 13 25.246 0.400 A 14 ASP H H 1 8.634 0.020 A 14 ASP HA H 1 4.014 0.020 A 14 ASP HBy H 1 2.349 0.020 A 14 ASP HBx H 1 2.037 0.020 A 14 ASP C C 13 175.085 0.400 A 14 ASP CA C 13 55.248 0.400 A 14 ASP CB C 13 37.747 0.400 A 14 ASP N N 15 120.875 0.400 A 15 SER H H 1 8.031 0.020 A 15 SER HA H 1 4.066 0.020 A 15 SER HBy H 1 3.910 0.020 A 15 SER HBx H 1 3.768 0.020 A 15 SER C C 13 173.079 0.400 A 15 SER CA C 13 57.230 0.400 A 15 SER CB C 13 59.603 0.400 A 15 SER N N 15 110.286 0.400 A 16 GLN H H 1 7.678 0.020 A 16 GLN HA H 1 4.364 0.020 A 16 GLN HBx H 1 1.808 0.020 A 16 GLN HBy H 1 1.808 0.020 A 16 GLN HGy H 1 2.407 0.020 A 16 GLN HGx H 1 2.047 0.020 A 16 GLN C C 13 172.098 0.400 A 16 GLN CA C 13 53.998 0.400 A 16 GLN CB C 13 26.110 0.400 A 16 GLN CG C 13 34.236 0.400 A 16 GLN N N 15 119.938 0.400 A 17 MET H H 1 7.883 0.020 A 17 MET HA H 1 5.302 0.020 A 17 MET HBy H 1 1.818 0.020 A 17 MET HBx H 1 1.720 0.020 A 17 MET HE% H 1 1.025 0.020 A 17 MET HGx H 1 2.058 0.020 A 17 MET HGy H 1 2.058 0.020 A 17 MET C C 13 170.918 0.400 A 17 MET CA C 13 52.871 0.400 A 17 MET CB C 13 31.500 0.400 A 17 MET CE C 13 20.686 0.400 A 17 MET CG C 13 31.500 0.400 A 17 MET N N 15 121.500 0.400 A 18 SER H H 1 9.217 0.020 A 18 SER HA H 1 4.623 0.020 A 18 SER HBx H 1 3.922 0.020 A 18 SER HBy H 1 3.922 0.020 A 18 SER C C 13 173.500 0.400 A 18 SER CA C 13 54.611 0.400 A 18 SER CB C 13 63.620 0.400 A 18 SER N N 15 115.858 0.400 A 19 ALA H H 1 8.414 0.020 A 19 ALA HA H 1 4.480 0.020 A 19 ALA HB% H 1 1.025 0.020 A 19 ALA C C 13 173.750 0.400 A 19 ALA CA C 13 48.998 0.400 A 19 ALA CB C 13 22.121 0.400 A 19 ALA N N 15 118.063 0.400 A 20 SER H H 1 7.323 0.020 A 20 SER HA H 1 5.650 0.020 A 20 SER HBx H 1 2.865 0.020 A 20 SER HBy H 1 2.865 0.020 A 20 SER C C 13 172.409 0.400 A 20 SER CA C 13 57.180 0.400 A 20 SER CB C 13 63.080 0.400 A 20 SER N N 15 115.209 0.400 A 21 SER H H 1 7.521 0.020 A 21 SER HA H 1 4.492 0.020 A 21 SER HBy H 1 4.104 0.020 A 21 SER HBx H 1 3.745 0.020 A 21 SER C C 13 169.771 0.400 A 21 SER CA C 13 55.860 0.400 A 21 SER CB C 13 61.049 0.400 A 21 SER N N 15 112.444 0.400 A 22 SER H H 1 8.603 0.020 A 22 SER HA H 1 5.231 0.020 A 22 SER HBy H 1 3.684 0.020 A 22 SER HBx H 1 3.572 0.020 A 22 SER C C 13 169.778 0.400 A 22 SER CA C 13 55.940 0.400 A 22 SER CB C 13 63.580 0.400 A 22 SER N N 15 111.275 0.400 A 23 TYR H H 1 8.348 0.020 A 23 TYR HA H 1 4.126 0.020 A 23 TYR HBy H 1 2.526 0.020 A 23 TYR HBx H 1 1.856 0.020 A 23 TYR C C 13 170.819 0.400 A 23 TYR CA C 13 55.030 0.400 A 23 TYR CB C 13 37.430 0.400 A 23 TYR N N 15 126.113 0.400 A 24 LYS H H 1 7.681 0.020 A 24 LYS HA H 1 4.297 0.020 A 24 LYS HBx H 1 1.748 0.020 A 24 LYS HBy H 1 1.748 0.020 A 24 LYS HDx H 1 1.650 0.020 A 24 LYS HDy H 1 1.650 0.020 A 24 LYS HEy H 1 2.530 0.020 A 24 LYS HEx H 1 1.889 0.020 A 24 LYS HGx H 1 1.571 0.020 A 24 LYS HGy H 1 1.571 0.020 A 24 LYS CA C 13 51.700 0.400 A 24 LYS CB C 13 30.900 0.400 A 24 LYS N N 15 126.567 0.400 A 30 ALA HA H 1 4.179 0.020 A 30 ALA HB% H 1 1.016 0.020 A 30 ALA C C 13 175.027 0.400 A 30 ALA CA C 13 50.873 0.400 A 30 ALA CB C 13 15.871 0.400 A 31 PHE H H 1 7.773 0.020 A 31 PHE HA H 1 4.683 0.020 A 31 PHE HBy H 1 3.272 0.020 A 31 PHE HBx H 1 3.013 0.020 A 31 PHE C C 13 171.796 0.400 A 31 PHE CA C 13 52.425 0.400 A 31 PHE CB C 13 36.420 0.400 A 31 PHE N N 15 117.750 0.400 A 32 GLY H H 1 6.889 0.020 A 32 GLY HAy H 1 4.171 0.020 A 32 GLY HAx H 1 2.310 0.020 A 32 GLY C C 13 170.875 0.400 A 32 GLY CA C 13 42.122 0.400 A 32 GLY N N 15 103.376 0.400 A 33 TRP H H 1 8.014 0.020 A 33 TRP HA H 1 4.493 0.020 A 33 TRP HBy H 1 3.013 0.020 A 33 TRP HBx H 1 2.960 0.020 A 33 TRP HE1 H 1 9.973 0.020 A 33 TRP CA C 13 53.373 0.400 A 33 TRP CB C 13 27.747 0.400 A 33 TRP N N 15 120.563 0.400 A 33 TRP NE1 N 15 130.100 0.400 A 35 PRO HA H 1 4.095 0.020 A 35 PRO HBx H 1 2.142 0.020 A 35 PRO HBy H 1 2.142 0.020 A 35 PRO HGy H 1 1.616 0.020 A 35 PRO HGx H 1 1.494 0.020 A 35 PRO C C 13 175.123 0.400 A 35 PRO CA C 13 62.474 0.400 A 35 PRO CB C 13 28.530 0.400 A 35 PRO CD C 13 48.177 0.400 A 35 PRO CG C 13 26.605 0.400 A 36 HIS H H 1 7.095 0.020 A 36 HIS HA H 1 5.363 0.020 A 36 HIS HBy H 1 3.698 0.020 A 36 HIS HBx H 1 2.992 0.020 A 36 HIS HD2 H 1 6.816 0.020 A 36 HIS C C 13 172.797 0.400 A 36 HIS CA C 13 54.623 0.400 A 36 HIS CB C 13 26.496 0.400 A 36 HIS N N 15 107.438 0.400 A 37 LEU H H 1 7.362 0.020 A 37 LEU HA H 1 4.124 0.020 A 37 LEU HBx H 1 1.703 0.020 A 37 LEU HBy H 1 1.703 0.020 A 37 LEU HDx% H 1 0.836 0.020 A 37 LEU HDy% H 1 0.743 0.020 A 37 LEU C C 13 177.068 0.400 A 37 LEU CA C 13 51.500 0.400 A 37 LEU CB C 13 38.010 0.400 A 37 LEU CD1 C 13 24.101 0.400 A 37 LEU CD2 C 13 24.101 0.400 A 37 LEU N N 15 119.077 0.400 A 38 GLY H H 1 8.259 0.020 A 38 GLY HAy H 1 4.792 0.020 A 38 GLY HAx H 1 3.478 0.020 A 38 GLY C C 13 171.943 0.400 A 38 GLY CA C 13 46.497 0.400 A 38 GLY N N 15 109.626 0.400 A 39 ARG H H 1 8.346 0.020 A 39 ARG HA H 1 4.648 0.020 A 39 ARG HBx H 1 1.558 0.020 A 39 ARG HBy H 1 1.558 0.020 A 39 ARG HDx H 1 2.949 0.020 A 39 ARG HDy H 1 2.949 0.020 A 39 ARG HGx H 1 1.147 0.020 A 39 ARG HGy H 1 1.147 0.020 A 39 ARG C C 13 172.685 0.400 A 39 ARG CA C 13 51.878 0.400 A 39 ARG CB C 13 31.146 0.400 A 39 ARG CG C 13 26.221 0.400 A 39 ARG N N 15 123.688 0.400 A 40 LEU H H 1 7.469 0.020 A 40 LEU HA H 1 3.546 0.020 A 40 LEU HBx H 1 1.494 0.020 A 40 LEU HBy H 1 1.494 0.020 A 40 LEU HDx% H 1 0.326 0.020 A 40 LEU HDy% H 1 0.326 0.020 A 40 LEU HG H 1 0.976 0.020 A 40 LEU C C 13 172.320 0.400 A 40 LEU CA C 13 53.212 0.400 A 40 LEU CB C 13 41.790 0.400 A 40 LEU CD1 C 13 23.140 0.400 A 40 LEU CD2 C 13 23.140 0.400 A 40 LEU N N 15 125.010 0.400 A 41 ASP H H 1 10.297 0.020 A 41 ASP HA H 1 4.250 0.020 A 41 ASP HBy H 1 3.042 0.020 A 41 ASP HBx H 1 2.783 0.020 A 41 ASP C C 13 173.206 0.400 A 41 ASP CA C 13 53.373 0.400 A 41 ASP CB C 13 36.496 0.400 A 41 ASP N N 15 119.625 0.400 A 42 ASN H H 1 8.217 0.020 A 42 ASN HA H 1 4.606 0.020 A 42 ASN HBy H 1 3.342 0.020 A 42 ASN HBx H 1 3.229 0.020 A 42 ASN HD2y H 1 7.794 0.020 A 42 ASN HD2x H 1 6.874 0.020 A 42 ASN C C 13 173.770 0.400 A 42 ASN CA C 13 52.123 0.400 A 42 ASN CB C 13 34.622 0.400 A 42 ASN N N 15 119.313 0.400 A 43 GLN H H 1 8.295 0.020 A 43 GLN HA H 1 4.638 0.020 A 43 GLN HBy H 1 2.143 0.020 A 43 GLN HBx H 1 1.885 0.020 A 43 GLN HGx H 1 2.434 0.020 A 43 GLN HGy H 1 2.434 0.020 A 43 GLN C C 13 172.453 0.400 A 43 GLN CA C 13 51.498 0.400 A 43 GLN CB C 13 28.997 0.400 A 43 GLN CG C 13 30.872 0.400 A 43 GLN N N 15 124.313 0.400 A 44 GLY H H 1 8.043 0.020 A 44 GLY HAy H 1 4.188 0.020 A 44 GLY HAx H 1 3.663 0.020 A 44 GLY C C 13 169.975 0.400 A 44 GLY CA C 13 40.872 0.400 A 44 GLY N N 15 108.063 0.400 A 45 LYS H H 1 8.073 0.020 A 45 LYS HA H 1 3.785 0.020 A 45 LYS HBx H 1 1.766 0.020 A 45 LYS HBy H 1 1.766 0.020 A 45 LYS HDx H 1 1.567 0.020 A 45 LYS HDy H 1 1.567 0.020 A 45 LYS HGy H 1 1.308 0.020 A 45 LYS HGx H 1 1.283 0.020 A 45 LYS C C 13 174.102 0.400 A 45 LYS CA C 13 56.329 0.400 A 45 LYS CB C 13 29.670 0.400 A 45 LYS CD C 13 25.969 0.400 A 45 LYS CG C 13 22.300 0.400 A 45 LYS N N 15 119.219 0.400 A 46 ILE H H 1 7.254 0.020 A 46 ILE HA H 1 4.196 0.020 A 46 ILE HB H 1 1.226 0.020 A 46 ILE HD1% H 1 0.464 0.020 A 46 ILE HG1y H 1 0.982 0.020 A 46 ILE HG1x H 1 0.466 0.020 A 46 ILE HG2% H 1 -0.896 0.020 A 46 ILE C C 13 173.399 0.400 A 46 ILE CA C 13 58.373 0.400 A 46 ILE CB C 13 33.997 0.400 A 46 ILE CD1 C 13 10.246 0.400 A 46 ILE CG1 C 13 23.996 0.400 A 46 ILE CG2 C 13 12.121 0.400 A 46 ILE N N 15 116.500 0.400 A 47 ASN H H 1 7.006 0.020 A 47 ASN HA H 1 4.414 0.020 A 47 ASN HBy H 1 2.335 0.020 A 47 ASN HBx H 1 1.931 0.020 A 47 ASN C C 13 167.748 0.400 A 47 ASN CA C 13 49.623 0.400 A 47 ASN CB C 13 35.247 0.400 A 47 ASN N N 15 124.000 0.400 A 48 ALA H H 1 6.848 0.020 A 48 ALA HA H 1 4.543 0.020 A 48 ALA HB% H 1 1.191 0.020 A 48 ALA C C 13 171.262 0.400 A 48 ALA CA C 13 47.747 0.400 A 48 ALA CB C 13 20.871 0.400 A 48 ALA N N 15 115.563 0.400 A 49 TRP H H 1 7.579 0.020 A 49 TRP HA H 1 4.780 0.020 A 49 TRP HBy H 1 3.180 0.020 A 49 TRP HBx H 1 2.928 0.020 A 49 TRP HE1 H 1 10.694 0.020 A 49 TRP C C 13 174.076 0.400 A 49 TRP CA C 13 53.373 0.400 A 49 TRP CB C 13 26.496 0.400 A 49 TRP N N 15 116.500 0.400 A 49 TRP NE1 N 15 133.101 0.400 A 50 THR H H 1 7.493 0.020 A 50 THR HA H 1 4.751 0.020 A 50 THR HB H 1 3.240 0.020 A 50 THR HG2% H 1 0.292 0.020 A 50 THR C C 13 169.682 0.400 A 50 THR CA C 13 56.498 0.400 A 50 THR CB C 13 69.624 0.400 A 50 THR CG2 C 13 18.371 0.400 A 50 THR N N 15 124.938 0.400 A 51 ALA H H 1 6.501 0.020 A 51 ALA HA H 1 3.680 0.020 A 51 ALA HB% H 1 0.885 0.020 A 51 ALA C C 13 175.139 0.400 A 51 ALA CA C 13 48.373 0.400 A 51 ALA CB C 13 16.496 0.400 A 51 ALA N N 15 126.813 0.400 A 52 GLN H H 1 8.608 0.020 A 52 GLN HA H 1 4.639 0.020 A 52 GLN HBy H 1 1.875 0.020 A 52 GLN HBx H 1 1.778 0.020 A 52 GLN HGy H 1 2.302 0.020 A 52 GLN HGx H 1 2.209 0.020 A 52 GLN C C 13 172.093 0.400 A 52 GLN CA C 13 56.720 0.400 A 52 GLN CB C 13 26.140 0.400 A 52 GLN CG C 13 31.140 0.400 A 52 GLN N N 15 121.188 0.400 A 53 SER H H 1 6.743 0.020 A 53 SER HA H 1 4.285 0.020 A 53 SER HBy H 1 3.822 0.020 A 53 SER HBx H 1 3.460 0.020 A 53 SER C C 13 171.207 0.400 A 53 SER CA C 13 52.930 0.400 A 53 SER CB C 13 63.130 0.400 A 53 SER N N 15 109.483 0.400 A 54 ASN H H 1 8.145 0.020 A 54 ASN HA H 1 3.983 0.020 A 54 ASN HBy H 1 2.503 0.020 A 54 ASN HBx H 1 2.009 0.020 A 54 ASN HD2x H 1 6.302 0.020 A 54 ASN HD2y H 1 7.157 0.020 A 54 ASN C C 13 170.818 0.400 A 54 ASN CA C 13 47.747 0.400 A 54 ASN CB C 13 33.997 0.400 A 54 ASN N N 15 119.313 0.400 A 54 ASN ND2 N 15 110.300 0.400 A 55 SER H H 1 6.349 0.020 A 55 SER HA H 1 4.581 0.020 A 55 SER HBy H 1 3.841 0.020 A 55 SER HBx H 1 3.476 0.020 A 55 SER C C 13 169.688 0.400 A 55 SER CA C 13 54.030 0.400 A 55 SER CB C 13 62.306 0.400 A 55 SER N N 15 117.331 0.400 A 56 ALA H H 1 8.812 0.020 A 56 ALA HA H 1 4.625 0.020 A 56 ALA HB% H 1 1.651 0.020 A 56 ALA C C 13 175.129 0.400 A 56 ALA CA C 13 50.248 0.400 A 56 ALA CB C 13 15.871 0.400 A 56 ALA N N 15 123.063 0.400 A 57 LYS H H 1 8.107 0.020 A 57 LYS HA H 1 4.467 0.020 A 57 LYS HBx H 1 1.984 0.020 A 57 LYS HBy H 1 1.984 0.020 A 57 LYS HDx H 1 1.565 0.020 A 57 LYS HDy H 1 1.565 0.020 A 57 LYS HEx H 1 3.171 0.020 A 57 LYS HEy H 1 3.171 0.020 A 57 LYS HGx H 1 1.297 0.020 A 57 LYS HGy H 1 1.297 0.020 A 57 LYS C C 13 173.977 0.400 A 57 LYS CA C 13 53.351 0.400 A 57 LYS CB C 13 29.777 0.400 A 57 LYS CD C 13 26.306 0.400 A 57 LYS CG C 13 22.149 0.400 A 57 LYS N N 15 117.895 0.400 A 58 GLU H H 1 7.389 0.020 A 58 GLU HA H 1 4.350 0.020 A 58 GLU HBx H 1 1.669 0.020 A 58 GLU HBy H 1 1.669 0.020 A 58 GLU HGx H 1 2.015 0.020 A 58 GLU HGy H 1 2.015 0.020 A 58 GLU CA C 13 52.410 0.400 A 58 GLU CB C 13 27.230 0.400 A 58 GLU CG C 13 32.445 0.400 A 58 GLU N N 15 119.625 0.400 A 59 TRP H H 1 8.747 0.020 A 59 TRP HA H 1 5.004 0.020 A 59 TRP HBy H 1 3.438 0.020 A 59 TRP HBx H 1 2.562 0.020 A 59 TRP HE1 H 1 9.796 0.020 A 59 TRP C C 13 169.955 0.400 A 59 TRP CA C 13 53.373 0.400 A 59 TRP CB C 13 28.372 0.400 A 59 TRP N N 15 111.188 0.400 A 59 TRP NE1 N 15 128.486 0.400 A 60 LEU H H 1 7.322 0.020 A 60 LEU HA H 1 4.184 0.020 A 60 LEU HBy H 1 1.131 0.020 A 60 LEU HBx H 1 0.966 0.020 A 60 LEU HDx% H 1 0.393 0.020 A 60 LEU HDy% H 1 0.291 0.020 A 60 LEU HG H 1 0.655 0.020 A 60 LEU C C 13 171.627 0.400 A 60 LEU CA C 13 50.880 0.400 A 60 LEU CB C 13 42.040 0.400 A 60 LEU CD1 C 13 20.676 0.400 A 60 LEU CD2 C 13 20.676 0.400 A 60 LEU CG C 13 24.431 0.400 A 60 LEU N N 15 119.000 0.400 A 61 GLN H H 1 9.649 0.020 A 61 GLN HA H 1 5.473 0.020 A 61 GLN HBx H 1 1.911 0.020 A 61 GLN HBy H 1 1.934 0.020 A 61 GLN HE2y H 1 6.421 0.020 A 61 GLN HGx H 1 2.315 0.020 A 61 GLN HGy H 1 2.315 0.020 A 61 GLN C C 13 170.955 0.400 A 61 GLN CA C 13 51.498 0.400 A 61 GLN CB C 13 31.450 0.400 A 61 GLN CG C 13 32.805 0.400 A 61 GLN N N 15 126.813 0.400 A 62 VAL H H 1 9.274 0.020 A 62 VAL HA H 1 4.553 0.020 A 62 VAL HB H 1 1.851 0.020 A 62 VAL HGx% H 1 0.824 0.020 A 62 VAL HGy% H 1 0.895 0.020 A 62 VAL C C 13 171.409 0.400 A 62 VAL CA C 13 58.373 0.400 A 62 VAL CB C 13 33.372 0.400 A 62 VAL CG1 C 13 19.621 0.400 A 62 VAL CG2 C 13 19.621 0.400 A 62 VAL N N 15 123.688 0.400 A 63 ASP H H 1 8.697 0.020 A 63 ASP HA H 1 4.728 0.020 A 63 ASP HBx H 1 2.599 0.020 A 63 ASP HBy H 1 2.909 0.020 A 63 ASP C C 13 173.626 0.400 A 63 ASP CA C 13 49.523 0.400 A 63 ASP CB C 13 39.057 0.400 A 63 ASP N N 15 125.563 0.400 A 64 LEU H H 1 9.392 0.020 A 64 LEU HA H 1 3.995 0.020 A 64 LEU HBx H 1 2.273 0.020 A 64 LEU HBy H 1 2.273 0.020 A 64 LEU HDx% H 1 0.704 0.020 A 64 LEU HDy% H 1 0.704 0.020 A 64 LEU HG H 1 1.521 0.020 A 64 LEU C C 13 176.284 0.400 A 64 LEU CA C 13 53.360 0.400 A 64 LEU CB C 13 38.995 0.400 A 64 LEU CD1 C 13 23.760 0.400 A 64 LEU CD2 C 13 23.760 0.400 A 64 LEU N N 15 124.313 0.400 A 65 GLY H H 1 9.004 0.020 A 65 GLY HAy H 1 4.162 0.020 A 65 GLY HAx H 1 3.125 0.020 A 65 GLY C C 13 169.373 0.400 A 65 GLY CA C 13 42.747 0.400 A 65 GLY N N 15 111.501 0.400 A 66 THR H H 1 7.314 0.020 A 66 THR HA H 1 4.165 0.020 A 66 THR HB H 1 4.021 0.020 A 66 THR HG2% H 1 0.843 0.020 A 66 THR C C 13 168.700 0.400 A 66 THR CA C 13 56.498 0.400 A 66 THR CB C 13 66.498 0.400 A 66 THR CG2 C 13 20.246 0.400 A 66 THR N N 15 112.126 0.400 A 67 GLN H H 1 7.837 0.020 A 67 GLN HA H 1 3.844 0.020 A 67 GLN HBy H 1 1.860 0.020 A 67 GLN HBx H 1 1.835 0.020 A 67 GLN HGy H 1 2.147 0.020 A 67 GLN HGx H 1 1.929 0.020 A 67 GLN C C 13 172.891 0.400 A 67 GLN CA C 13 53.998 0.400 A 67 GLN CB C 13 26.496 0.400 A 67 GLN CG C 13 32.122 0.400 A 67 GLN N N 15 120.250 0.400 A 68 ARG H H 1 8.445 0.020 A 68 ARG HA H 1 4.627 0.020 A 68 ARG HBy H 1 1.545 0.020 A 68 ARG HBx H 1 1.453 0.020 A 68 ARG HDy H 1 3.220 0.020 A 68 ARG HDx H 1 2.887 0.020 A 68 ARG HE H 1 7.365 0.020 A 68 ARG HGy H 1 1.708 0.020 A 68 ARG HGx H 1 1.507 0.020 A 68 ARG C C 13 171.255 0.400 A 68 ARG CA C 13 50.248 0.400 A 68 ARG CB C 13 30.872 0.400 A 68 ARG CD C 13 40.247 0.400 A 68 ARG CG C 13 23.342 0.400 A 68 ARG N N 15 124.313 0.400 A 69 GLN H H 1 8.554 0.020 A 69 GLN HA H 1 4.643 0.020 A 69 GLN HBx H 1 1.651 0.020 A 69 GLN HBy H 1 1.651 0.020 A 69 GLN HGx H 1 1.811 0.020 A 69 GLN HGy H 1 1.829 0.020 A 69 GLN C C 13 171.250 0.400 A 69 GLN CA C 13 53.141 0.400 A 69 GLN CB C 13 26.549 0.400 A 69 GLN CG C 13 32.288 0.400 A 69 GLN N N 15 121.188 0.400 A 70 VAL H H 1 8.880 0.020 A 70 VAL HA H 1 4.254 0.020 A 70 VAL HB H 1 1.005 0.020 A 70 VAL HGx% H 1 0.620 0.020 A 70 VAL HGy% H 1 0.961 0.020 A 70 VAL C C 13 172.746 0.400 A 70 VAL CA C 13 60.248 0.400 A 70 VAL CB C 13 28.997 0.400 A 70 VAL CG1 C 13 18.371 0.400 A 70 VAL CG2 C 13 20.246 0.400 A 70 VAL N N 15 130.250 0.400 A 71 THR H H 1 9.274 0.020 A 71 THR HA H 1 4.386 0.020 A 71 THR HB H 1 4.268 0.020 A 71 THR HG2% H 1 1.052 0.020 A 71 THR C C 13 172.844 0.400 A 71 THR CA C 13 58.373 0.400 A 71 THR CB C 13 67.748 0.400 A 71 THR CG2 C 13 19.621 0.400 A 71 THR N N 15 113.376 0.400 A 72 GLY H H 1 7.637 0.020 A 72 GLY HAy H 1 3.604 0.020 A 72 GLY HAx H 1 2.808 0.020 A 72 GLY C C 13 168.437 0.400 A 72 GLY CA C 13 43.372 0.400 A 72 GLY N N 15 110.563 0.400 A 73 ILE H H 1 8.401 0.020 A 73 ILE HA H 1 4.807 0.020 A 73 ILE HD1% H 1 0.605 0.020 A 73 ILE HG2% H 1 0.644 0.020 A 73 ILE C C 13 168.322 0.400 A 73 ILE CA C 13 56.969 0.400 A 73 ILE CB C 13 39.529 0.400 A 73 ILE CD1 C 13 11.823 0.400 A 73 ILE CG1 C 13 28.272 0.400 A 73 ILE CG2 C 13 13.573 0.400 A 73 ILE N N 15 117.729 0.400 A 74 ILE H H 1 8.599 0.020 A 74 ILE HA H 1 5.065 0.020 A 74 ILE HB H 1 1.285 0.020 A 74 ILE HD1% H 1 0.581 0.020 A 74 ILE HG1y H 1 1.278 0.020 A 74 ILE HG1x H 1 1.067 0.020 A 74 ILE HG2% H 1 0.677 0.020 A 74 ILE C C 13 172.553 0.400 A 74 ILE CA C 13 57.123 0.400 A 74 ILE CB C 13 38.372 0.400 A 74 ILE CD1 C 13 11.451 0.400 A 74 ILE CG1 C 13 23.807 0.400 A 74 ILE CG2 C 13 16.773 0.400 A 74 ILE N N 15 124.625 0.400 A 75 THR H H 1 8.116 0.020 A 75 THR HA H 1 5.563 0.020 A 75 THR HB H 1 4.406 0.020 A 75 THR HG2% H 1 0.867 0.020 A 75 THR C C 13 171.547 0.400 A 75 THR CA C 13 57.123 0.400 A 75 THR CB C 13 70.249 0.400 A 75 THR CG2 C 13 17.121 0.400 A 75 THR N N 15 112.126 0.400 A 76 GLN H H 1 8.833 0.020 A 76 GLN HA H 1 4.738 0.020 A 76 GLN HBx H 1 1.814 0.020 A 76 GLN HBy H 1 1.814 0.020 A 76 GLN HE2x H 1 6.804 0.020 A 76 GLN HE2y H 1 7.643 0.020 A 76 GLN HGx H 1 2.294 0.020 A 76 GLN HGy H 1 2.364 0.020 A 76 GLN C C 13 173.459 0.400 A 76 GLN CA C 13 51.840 0.400 A 76 GLN CB C 13 33.430 0.400 A 76 GLN CG C 13 31.776 0.400 A 76 GLN N N 15 124.313 0.400 A 76 GLN NE2 N 15 112.823 0.400 A 77 GLY H H 1 8.898 0.020 A 77 GLY HAy H 1 4.690 0.020 A 77 GLY HAx H 1 4.117 0.020 A 77 GLY C C 13 170.042 0.400 A 77 GLY CA C 13 41.939 0.400 A 77 GLY N N 15 112.703 0.400 A 78 ALA H H 1 9.176 0.020 A 78 ALA HA H 1 4.619 0.020 A 78 ALA HB% H 1 1.454 0.020 A 78 ALA C C 13 171.587 0.400 A 78 ALA CA C 13 50.248 0.400 A 78 ALA CB C 13 18.371 0.400 A 78 ALA N N 15 119.938 0.400 A 79 ARG H H 1 8.219 0.020 A 79 ARG HA H 1 5.149 0.020 A 79 ARG HBy H 1 1.595 0.020 A 79 ARG HBx H 1 1.387 0.020 A 79 ARG HDx H 1 2.941 0.020 A 79 ARG HDy H 1 2.941 0.020 A 79 ARG HGy H 1 1.286 0.020 A 79 ARG HGx H 1 1.194 0.020 A 79 ARG C C 13 171.346 0.400 A 79 ARG CA C 13 52.123 0.400 A 79 ARG CB C 13 31.497 0.400 A 79 ARG CD C 13 40.872 0.400 A 79 ARG CG C 13 23.996 0.400 A 79 ARG N N 15 118.063 0.400 A 80 ASP H H 1 8.325 0.020 A 80 ASP HA H 1 4.930 0.020 A 80 ASP HBy H 1 2.450 0.020 A 80 ASP HBx H 1 1.926 0.020 A 80 ASP C C 13 173.298 0.400 A 80 ASP CA C 13 50.248 0.400 A 80 ASP CB C 13 39.622 0.400 A 80 ASP N N 15 123.688 0.400 A 81 PHE H H 1 8.835 0.020 A 81 PHE HA H 1 3.917 0.020 A 81 PHE HBy H 1 3.274 0.020 A 81 PHE HBx H 1 2.928 0.020 A 81 PHE HD1 H 1 7.295 0.020 A 81 PHE HD2 H 1 7.295 0.020 A 81 PHE C C 13 172.922 0.400 A 81 PHE CA C 13 57.123 0.400 A 81 PHE CB C 13 33.997 0.400 A 81 PHE N N 15 125.563 0.400 A 82 GLY H H 1 8.333 0.020 A 82 GLY HAy H 1 3.825 0.020 A 82 GLY HAx H 1 3.452 0.020 A 82 GLY C C 13 168.629 0.400 A 82 GLY CA C 13 42.480 0.400 A 82 GLY N N 15 104.822 0.400 A 83 HIS H H 1 8.020 0.020 A 83 HIS HA H 1 4.684 0.020 A 83 HIS HBy H 1 3.213 0.020 A 83 HIS HBx H 1 2.728 0.020 A 83 HIS C C 13 171.863 0.400 A 83 HIS CA C 13 52.883 0.400 A 83 HIS CB C 13 27.840 0.400 A 83 HIS N N 15 119.318 0.400 A 84 ILE H H 1 9.123 0.020 A 84 ILE HA H 1 3.883 0.020 A 84 ILE HB H 1 1.944 0.020 A 84 ILE HD1% H 1 1.003 0.020 A 84 ILE HG1x H 1 1.638 0.020 A 84 ILE HG1y H 1 1.638 0.020 A 84 ILE HG2% H 1 1.003 0.020 A 84 ILE C C 13 172.641 0.400 A 84 ILE CA C 13 60.214 0.400 A 84 ILE CB C 13 35.531 0.400 A 84 ILE CD1 C 13 10.295 0.400 A 84 ILE N N 15 119.318 0.400 A 85 GLN H H 1 8.569 0.020 A 85 GLN HA H 1 5.230 0.020 A 85 GLN HBy H 1 1.864 0.020 A 85 GLN HBx H 1 1.296 0.020 A 85 GLN HE2y H 1 7.896 0.020 A 85 GLN HGx H 1 2.156 0.020 A 85 GLN HGy H 1 2.156 0.020 A 85 GLN C C 13 170.761 0.400 A 85 GLN CA C 13 51.251 0.400 A 85 GLN CB C 13 29.010 0.400 A 85 GLN CG C 13 32.091 0.400 A 85 GLN N N 15 126.188 0.400 A 86 TYR H H 1 7.808 0.020 A 86 TYR HA H 1 5.207 0.020 A 86 TYR HBy H 1 3.455 0.020 A 86 TYR HBx H 1 2.955 0.020 A 86 TYR HH H 1 8.886 0.020 A 86 TYR C C 13 170.556 0.400 A 86 TYR CA C 13 53.998 0.400 A 86 TYR CB C 13 35.872 0.400 A 86 TYR N N 15 114.001 0.400 A 87 VAL H H 1 10.249 0.020 A 87 VAL HA H 1 4.291 0.020 A 87 VAL HB H 1 2.558 0.020 A 87 VAL HGx% H 1 1.404 0.020 A 87 VAL HGy% H 1 1.151 0.020 A 87 VAL C C 13 171.985 0.400 A 87 VAL CA C 13 61.498 0.400 A 87 VAL CB C 13 29.622 0.400 A 87 VAL CG1 C 13 21.496 0.400 A 87 VAL CG2 C 13 22.121 0.400 A 87 VAL N N 15 121.500 0.400 A 88 ALA H H 1 9.007 0.020 A 88 ALA HA H 1 5.049 0.020 A 88 ALA HB% H 1 1.452 0.020 A 88 ALA C C 13 176.128 0.400 A 88 ALA CA C 13 49.623 0.400 A 88 ALA CB C 13 17.121 0.400 A 88 ALA N N 15 133.375 0.400 A 89 SER H H 1 8.130 0.020 A 89 SER HA H 1 5.243 0.020 A 89 SER HBx H 1 3.528 0.020 A 89 SER HBy H 1 3.663 0.020 A 89 SER C C 13 170.956 0.400 A 89 SER CA C 13 55.936 0.400 A 89 SER CB C 13 61.880 0.400 A 89 SER N N 15 113.404 0.400 A 90 TYR H H 1 8.421 0.020 A 90 TYR HA H 1 5.427 0.020 A 90 TYR HBx H 1 3.056 0.020 A 90 TYR HBy H 1 3.056 0.020 A 90 TYR C C 13 169.423 0.400 A 90 TYR CA C 13 54.735 0.400 A 90 TYR CB C 13 37.570 0.400 A 90 TYR N N 15 117.750 0.400 A 91 LYS H H 1 9.256 0.020 A 91 LYS HA H 1 5.311 0.020 A 91 LYS HBx H 1 1.762 0.020 A 91 LYS HBy H 1 1.762 0.020 A 91 LYS HDx H 1 1.640 0.020 A 91 LYS HDy H 1 1.640 0.020 A 91 LYS HEx H 1 3.078 0.020 A 91 LYS HEy H 1 3.078 0.020 A 91 LYS C C 13 172.713 0.400 A 91 LYS CA C 13 52.245 0.400 A 91 LYS CB C 13 34.100 0.400 A 91 LYS CE C 13 39.127 0.400 A 91 LYS N N 15 119.641 0.400 A 92 VAL H H 1 9.971 0.020 A 92 VAL HA H 1 5.063 0.020 A 92 VAL HB H 1 1.967 0.020 A 92 VAL HGx% H 1 0.933 0.020 A 92 VAL HGy% H 1 1.067 0.020 A 92 VAL C C 13 170.680 0.400 A 92 VAL CA C 13 58.998 0.400 A 92 VAL CB C 13 32.747 0.400 A 92 VAL CG1 C 13 18.371 0.400 A 92 VAL CG2 C 13 20.246 0.400 A 92 VAL N N 15 121.813 0.400 A 93 ALA H H 1 9.149 0.020 A 93 ALA HA H 1 5.654 0.020 A 93 ALA HB% H 1 1.211 0.020 A 93 ALA C C 13 173.000 0.400 A 93 ALA CA C 13 46.497 0.400 A 93 ALA CB C 13 21.496 0.400 A 93 ALA N N 15 126.813 0.400 A 94 HIS H H 1 9.177 0.020 A 94 HIS HA H 1 5.894 0.020 A 94 HIS HBy H 1 3.105 0.020 A 94 HIS HBx H 1 2.550 0.020 A 94 HIS HD2 H 1 6.467 0.020 A 94 HIS HE1 H 1 6.837 0.020 A 94 HIS C C 13 170.442 0.400 A 94 HIS CA C 13 51.498 0.400 A 94 HIS CB C 13 30.872 0.400 A 94 HIS N N 15 116.813 0.400 A 95 SER H H 1 8.715 0.020 A 95 SER HA H 1 4.716 0.020 A 95 SER HBy H 1 3.698 0.020 A 95 SER HBx H 1 3.620 0.020 A 95 SER C C 13 171.390 0.400 A 95 SER CA C 13 54.580 0.400 A 95 SER CB C 13 61.560 0.400 A 95 SER N N 15 112.837 0.400 A 96 ASP H H 1 9.113 0.020 A 96 ASP HA H 1 5.124 0.020 A 96 ASP HBy H 1 2.630 0.020 A 96 ASP HBx H 1 2.457 0.020 A 96 ASP C C 13 173.389 0.400 A 96 ASP CA C 13 52.941 0.400 A 96 ASP CB C 13 39.625 0.400 A 96 ASP N N 15 126.188 0.400 A 97 ASP H H 1 7.977 0.020 A 97 ASP HA H 1 4.685 0.020 A 97 ASP HBy H 1 2.740 0.020 A 97 ASP HBx H 1 2.427 0.020 A 97 ASP C C 13 174.017 0.400 A 97 ASP CA C 13 50.520 0.400 A 97 ASP CB C 13 39.240 0.400 A 97 ASP N N 15 117.555 0.400 A 98 GLY H H 1 8.199 0.020 A 98 GLY HAy H 1 2.972 0.020 A 98 GLY HAx H 1 2.015 0.020 A 98 GLY C C 13 169.676 0.400 A 98 GLY CA C 13 41.497 0.400 A 98 GLY N N 15 112.126 0.400 A 99 VAL H H 1 7.968 0.020 A 99 VAL HA H 1 3.783 0.020 A 99 VAL HB H 1 1.585 0.020 A 99 VAL HGx% H 1 0.521 0.020 A 99 VAL HGy% H 1 0.715 0.020 A 99 VAL C C 13 172.402 0.400 A 99 VAL CA C 13 60.873 0.400 A 99 VAL CB C 13 31.497 0.400 A 99 VAL CG1 C 13 17.746 0.400 A 99 VAL CG2 C 13 18.371 0.400 A 99 VAL N N 15 121.188 0.400 A 100 GLN H H 1 8.891 0.020 A 100 GLN HA H 1 4.382 0.020 A 100 GLN HBy H 1 1.860 0.020 A 100 GLN HBx H 1 1.835 0.020 A 100 GLN HE2x H 1 6.812 0.020 A 100 GLN HE2y H 1 7.405 0.020 A 100 GLN HGy H 1 2.232 0.020 A 100 GLN HGx H 1 2.105 0.020 A 100 GLN C C 13 173.365 0.400 A 100 GLN CA C 13 51.797 0.400 A 100 GLN CB C 13 26.496 0.400 A 100 GLN CG C 13 30.872 0.400 A 100 GLN N N 15 120.875 0.400 A 100 GLN NE2 N 15 111.810 0.400 A 101 TRP H H 1 8.938 0.020 A 101 TRP HA H 1 4.392 0.020 A 101 TRP HBy H 1 2.694 0.020 A 101 TRP HBx H 1 2.600 0.020 A 101 TRP HD1 H 1 6.783 0.020 A 101 TRP HE1 H 1 8.795 0.020 A 101 TRP C C 13 172.642 0.400 A 101 TRP CA C 13 54.623 0.400 A 101 TRP CB C 13 28.997 0.400 A 101 TRP N N 15 128.688 0.400 A 101 TRP NE1 N 15 128.574 0.400 A 102 THR H H 1 8.967 0.020 A 102 THR HA H 1 4.200 0.020 A 102 THR HB H 1 2.659 0.020 A 102 THR HG2% H 1 0.841 0.020 A 102 THR C C 13 170.541 0.400 A 102 THR CA C 13 58.998 0.400 A 102 THR CB C 13 67.748 0.400 A 102 THR CG2 C 13 18.996 0.400 A 102 THR N N 15 121.500 0.400 A 103 VAL H H 1 8.720 0.020 A 103 VAL HA H 1 4.163 0.020 A 103 VAL HB H 1 1.881 0.020 A 103 VAL HGx% H 1 0.831 0.020 A 103 VAL HGy% H 1 0.990 0.020 A 103 VAL C C 13 173.011 0.400 A 103 VAL CA C 13 59.623 0.400 A 103 VAL CB C 13 28.997 0.400 A 103 VAL CG1 C 13 18.371 0.400 A 103 VAL CG2 C 13 19.621 0.400 A 103 VAL N N 15 128.063 0.400 A 104 TYR H H 1 9.250 0.020 A 104 TYR HA H 1 4.134 0.020 A 104 TYR HBx H 1 2.472 0.020 A 104 TYR HBy H 1 2.475 0.020 A 104 TYR HD1 H 1 7.068 0.020 A 104 TYR HD2 H 1 7.068 0.020 A 104 TYR C C 13 172.043 0.400 A 104 TYR CA C 13 57.742 0.400 A 104 TYR CB C 13 36.040 0.400 A 104 TYR N N 15 129.625 0.400 A 105 GLU H H 1 7.531 0.020 A 105 GLU HA H 1 4.582 0.020 A 105 GLU HBy H 1 1.526 0.020 A 105 GLU HBx H 1 1.460 0.020 A 105 GLU HGy H 1 2.157 0.020 A 105 GLU HGx H 1 1.638 0.020 A 105 GLU C C 13 171.799 0.400 A 105 GLU CA C 13 51.498 0.400 A 105 GLU CB C 13 30.872 0.400 A 105 GLU CG C 13 32.747 0.400 A 105 GLU N N 15 128.688 0.400 A 106 GLU H H 1 8.032 0.020 A 106 GLU HA H 1 4.231 0.020 A 106 GLU HBy H 1 1.938 0.020 A 106 GLU HBx H 1 1.719 0.020 A 106 GLU HGx H 1 2.314 0.020 A 106 GLU HGy H 1 2.314 0.020 A 106 GLU C C 13 173.234 0.400 A 106 GLU CA C 13 53.373 0.400 A 106 GLU CB C 13 31.497 0.400 A 106 GLU CG C 13 34.622 0.400 A 106 GLU N N 15 116.640 0.400 A 107 GLN H H 1 9.371 0.020 A 107 GLN HA H 1 3.805 0.020 A 107 GLN HBx H 1 2.009 0.020 A 107 GLN HBy H 1 2.009 0.020 A 107 GLN HGx H 1 2.252 0.020 A 107 GLN HGy H 1 2.252 0.020 A 107 GLN C C 13 173.764 0.400 A 107 GLN CA C 13 53.756 0.400 A 107 GLN CB C 13 23.750 0.400 A 107 GLN CG C 13 31.615 0.400 A 107 GLN N N 15 120.026 0.400 A 108 GLY H H 1 8.749 0.020 A 108 GLY HAy H 1 4.035 0.020 A 108 GLY HAx H 1 3.486 0.020 A 108 GLY C C 13 171.267 0.400 A 108 GLY CA C 13 42.747 0.400 A 108 GLY N N 15 104.938 0.400 A 109 SER H H 1 7.480 0.020 A 109 SER HA H 1 4.689 0.020 A 109 SER HBy H 1 3.700 0.020 A 109 SER HBx H 1 3.633 0.020 A 109 SER C C 13 170.661 0.400 A 109 SER CA C 13 53.998 0.400 A 109 SER CB C 13 62.940 0.400 A 109 SER N N 15 113.391 0.400 A 110 SER H H 1 8.617 0.020 A 110 SER HA H 1 4.127 0.020 A 110 SER HBx H 1 3.633 0.020 A 110 SER HBy H 1 3.633 0.020 A 110 SER C C 13 171.149 0.400 A 110 SER CA C 13 56.520 0.400 A 110 SER CB C 13 60.320 0.400 A 110 SER N N 15 118.362 0.400 A 111 LYS H H 1 8.393 0.020 A 111 LYS HA H 1 4.115 0.020 A 111 LYS HBy H 1 1.781 0.020 A 111 LYS HBx H 1 1.765 0.020 A 111 LYS HDy H 1 1.227 0.020 A 111 LYS HDx H 1 1.071 0.020 A 111 LYS HGx H 1 1.283 0.020 A 111 LYS HGy H 1 1.283 0.020 A 111 LYS C C 13 171.604 0.400 A 111 LYS CA C 13 52.780 0.400 A 111 LYS CB C 13 31.100 0.400 A 111 LYS CD C 13 25.856 0.400 A 111 LYS CE C 13 39.756 0.400 A 111 LYS CG C 13 21.827 0.400 A 111 LYS N N 15 127.630 0.400 A 112 VAL H H 1 8.486 0.020 A 112 VAL HA H 1 4.031 0.020 A 112 VAL HB H 1 1.828 0.020 A 112 VAL HGx% H 1 0.762 0.020 A 112 VAL HGy% H 1 0.676 0.020 A 112 VAL C C 13 173.267 0.400 A 112 VAL CA C 13 58.998 0.400 A 112 VAL CB C 13 27.747 0.400 A 112 VAL CG1 C 13 18.371 0.400 A 112 VAL CG2 C 13 18.996 0.400 A 112 VAL N N 15 128.063 0.400 A 113 PHE H H 1 9.197 0.020 A 113 PHE HA H 1 3.955 0.020 A 113 PHE HBy H 1 2.253 0.020 A 113 PHE HBx H 1 1.384 0.020 A 113 PHE HD1 H 1 7.076 0.020 A 113 PHE HD2 H 1 7.076 0.020 A 113 PHE C C 13 173.331 0.400 A 113 PHE CA C 13 55.873 0.400 A 113 PHE CB C 13 36.497 0.400 A 113 PHE N N 15 128.375 0.400 A 114 GLN H H 1 8.798 0.020 A 114 GLN HA H 1 3.980 0.020 A 114 GLN HBy H 1 2.070 0.020 A 114 GLN HBx H 1 1.953 0.020 A 114 GLN HE2x H 1 6.836 0.020 A 114 GLN HE2y H 1 7.569 0.020 A 114 GLN HGx H 1 2.392 0.020 A 114 GLN HGy H 1 2.392 0.020 A 114 GLN C C 13 172.287 0.400 A 114 GLN CA C 13 53.373 0.400 A 114 GLN CB C 13 25.871 0.400 A 114 GLN CG C 13 30.872 0.400 A 114 GLN N N 15 119.938 0.400 A 114 GLN NE2 N 15 114.308 0.400 A 115 GLY H H 1 7.969 0.020 A 115 GLY HAy H 1 4.613 0.020 A 115 GLY HAx H 1 3.199 0.020 A 115 GLY C C 13 169.807 0.400 A 115 GLY CA C 13 40.872 0.400 A 115 GLY N N 15 112.751 0.400 A 116 ASN H H 1 8.279 0.020 A 116 ASN HA H 1 4.297 0.020 A 116 ASN HBy H 1 2.957 0.020 A 116 ASN HBx H 1 2.342 0.020 A 116 ASN C C 13 169.146 0.400 A 116 ASN CA C 13 53.373 0.400 A 116 ASN CB C 13 40.872 0.400 A 116 ASN N N 15 119.938 0.400 A 117 LEU H H 1 8.416 0.020 A 117 LEU HA H 1 3.848 0.020 A 117 LEU HBy H 1 1.514 0.020 A 117 LEU HBx H 1 1.245 0.020 A 117 LEU HDx% H 1 0.661 0.020 A 117 LEU HDy% H 1 0.785 0.020 A 117 LEU HG H 1 1.392 0.020 A 117 LEU C C 13 172.092 0.400 A 117 LEU CA C 13 51.498 0.400 A 117 LEU CB C 13 41.497 0.400 A 117 LEU CD1 C 13 22.121 0.400 A 117 LEU CD2 C 13 21.496 0.400 A 117 LEU CG C 13 23.371 0.400 A 117 LEU N N 15 114.313 0.400 A 118 ASP H H 1 6.768 0.020 A 118 ASP HA H 1 3.976 0.020 A 118 ASP HBy H 1 2.831 0.020 A 118 ASP HBx H 1 2.759 0.020 A 118 ASP C C 13 171.626 0.400 A 118 ASP CA C 13 50.040 0.400 A 118 ASP CB C 13 37.480 0.400 A 118 ASP N N 15 115.563 0.400 A 119 ASN H H 1 8.638 0.020 A 119 ASN HA H 1 4.503 0.020 A 119 ASN HBx H 1 2.430 0.020 A 119 ASN HBy H 1 2.430 0.020 A 119 ASN C C 13 170.395 0.400 A 119 ASN CA C 13 52.123 0.400 A 119 ASN CB C 13 35.247 0.400 A 119 ASN N N 15 106.813 0.400 A 120 ASN H H 1 7.781 0.020 A 120 ASN HA H 1 5.091 0.020 A 120 ASN HBy H 1 2.668 0.020 A 120 ASN HBx H 1 2.535 0.020 A 120 ASN HD2x H 1 6.803 0.020 A 120 ASN HD2y H 1 7.641 0.020 A 120 ASN C C 13 174.859 0.400 A 120 ASN CA C 13 50.248 0.400 A 120 ASN CB C 13 39.622 0.400 A 120 ASN N N 15 113.376 0.400 A 120 ASN ND2 N 15 112.913 0.400 A 121 SER H H 1 9.296 0.020 A 121 SER HA H 1 3.972 0.020 A 121 SER HBx H 1 3.697 0.020 A 121 SER HBy H 1 3.697 0.020 A 121 SER C C 13 171.620 0.400 A 121 SER CA C 13 57.630 0.400 A 121 SER CB C 13 58.515 0.400 A 121 SER N N 15 121.403 0.400 A 122 HIS H H 1 9.011 0.020 A 122 HIS HA H 1 4.528 0.020 A 122 HIS HBy H 1 3.003 0.020 A 122 HIS HBx H 1 2.645 0.020 A 122 HIS HD1 H 1 6.658 0.020 A 122 HIS HD2 H 1 6.671 0.020 A 122 HIS C C 13 173.986 0.400 A 122 HIS CA C 13 52.123 0.400 A 122 HIS CB C 13 29.622 0.400 A 122 HIS N N 15 123.065 0.400 A 123 LYS H H 1 8.282 0.020 A 123 LYS HA H 1 4.717 0.020 A 123 LYS HBy H 1 1.791 0.020 A 123 LYS HBx H 1 1.781 0.020 A 123 LYS HDx H 1 1.666 0.020 A 123 LYS HDy H 1 1.666 0.020 A 123 LYS HEx H 1 2.885 0.020 A 123 LYS HEy H 1 2.885 0.020 A 123 LYS HGx H 1 1.276 0.020 A 123 LYS HGy H 1 1.276 0.020 A 123 LYS C C 13 171.766 0.400 A 123 LYS CA C 13 52.172 0.400 A 123 LYS CB C 13 31.037 0.400 A 123 LYS CD C 13 25.555 0.400 A 123 LYS CE C 13 39.298 0.400 A 123 LYS CG C 13 23.359 0.400 A 123 LYS N N 15 122.465 0.400 A 124 LYS H H 1 9.318 0.020 A 124 LYS HA H 1 5.071 0.020 A 124 LYS HBx H 1 1.728 0.020 A 124 LYS HBy H 1 1.728 0.020 A 124 LYS HEy H 1 2.685 0.020 A 124 LYS HEx H 1 2.630 0.020 A 124 LYS HGx H 1 1.453 0.020 A 124 LYS HGy H 1 1.453 0.020 A 124 LYS C C 13 172.047 0.400 A 124 LYS CA C 13 51.820 0.400 A 124 LYS CB C 13 31.150 0.400 A 124 LYS CG C 13 23.359 0.400 A 124 LYS N N 15 134.203 0.400 A 125 ASN H H 1 9.109 0.020 A 125 ASN HA H 1 5.062 0.020 A 125 ASN HBy H 1 2.307 0.020 A 125 ASN HBx H 1 2.014 0.020 A 125 ASN C C 13 169.738 0.400 A 125 ASN CA C 13 49.623 0.400 A 125 ASN CB C 13 40.247 0.400 A 125 ASN N N 15 124.625 0.400 A 126 ILE H H 1 8.528 0.020 A 126 ILE HA H 1 4.181 0.020 A 126 ILE HB H 1 1.774 0.020 A 126 ILE HD1% H 1 0.583 0.020 A 126 ILE HG1x H 1 1.229 0.020 A 126 ILE HG1y H 1 1.229 0.020 A 126 ILE HG2% H 1 0.746 0.020 A 126 ILE C C 13 173.527 0.400 A 126 ILE CA C 13 55.873 0.400 A 126 ILE CB C 13 36.497 0.400 A 126 ILE CD1 C 13 8.996 0.400 A 126 ILE CG2 C 13 15.246 0.400 A 126 ILE N N 15 120.250 0.400 A 127 PHE H H 1 7.928 0.020 A 127 PHE HA H 1 4.747 0.020 A 127 PHE HBy H 1 3.199 0.020 A 127 PHE HBx H 1 2.456 0.020 A 127 PHE HD1 H 1 6.495 0.020 A 127 PHE HD2 H 1 6.495 0.020 A 127 PHE C C 13 173.046 0.400 A 127 PHE CA C 13 52.748 0.400 A 127 PHE CB C 13 34.622 0.400 A 127 PHE N N 15 126.500 0.400 A 128 GLU H H 1 8.537 0.020 A 128 GLU HA H 1 4.067 0.020 A 128 GLU HBx H 1 2.091 0.020 A 128 GLU HBy H 1 2.091 0.020 A 128 GLU HGy H 1 2.454 0.020 A 128 GLU HGx H 1 2.310 0.020 A 128 GLU C C 13 174.143 0.400 A 128 GLU CA C 13 56.498 0.400 A 128 GLU CB C 13 27.121 0.400 A 128 GLU CG C 13 33.997 0.400 A 128 GLU N N 15 125.250 0.400 A 129 LYS H H 1 7.819 0.020 A 129 LYS HA H 1 4.872 0.020 A 129 LYS HBx H 1 1.925 0.020 A 129 LYS HBy H 1 1.925 0.020 A 129 LYS HDy H 1 1.740 0.020 A 129 LYS HDx H 1 1.632 0.020 A 129 LYS HEx H 1 3.000 0.020 A 129 LYS HEy H 1 3.000 0.020 A 129 LYS HGx H 1 1.435 0.020 A 129 LYS HGy H 1 1.435 0.020 A 129 LYS CA C 13 50.045 0.400 A 129 LYS CB C 13 30.255 0.400 A 129 LYS N N 15 116.343 0.400 A 130 PRO HA H 1 4.279 0.020 A 130 PRO HBx H 1 2.165 0.020 A 130 PRO HBy H 1 2.165 0.020 A 130 PRO HDx H 1 3.593 0.020 A 130 PRO HDy H 1 3.593 0.020 A 130 PRO HGx H 1 1.947 0.020 A 130 PRO HGy H 1 1.947 0.020 A 130 PRO C C 13 172.119 0.400 A 130 PRO CA C 13 61.117 0.400 A 130 PRO CB C 13 30.550 0.400 A 131 PHE H H 1 6.978 0.020 A 131 PHE HA H 1 5.053 0.020 A 131 PHE HBy H 1 2.839 0.020 A 131 PHE HBx H 1 2.501 0.020 A 131 PHE C C 13 170.026 0.400 A 131 PHE CA C 13 50.248 0.400 A 131 PHE CB C 13 38.372 0.400 A 131 PHE N N 15 115.563 0.400 A 132 MET H H 1 8.373 0.020 A 132 MET HA H 1 5.435 0.020 A 132 MET HBy H 1 1.926 0.020 A 132 MET HBx H 1 1.900 0.020 A 132 MET HE% H 1 1.735 0.020 A 132 MET HGx H 1 2.425 0.020 A 132 MET HGy H 1 2.425 0.020 A 132 MET C C 13 173.738 0.400 A 132 MET CA C 13 49.623 0.400 A 132 MET CB C 13 29.160 0.400 A 132 MET CE C 13 13.371 0.400 A 132 MET CG C 13 28.997 0.400 A 132 MET N N 15 118.375 0.400 A 133 ALA H H 1 9.138 0.020 A 133 ALA HA H 1 4.902 0.020 A 133 ALA HB% H 1 1.627 0.020 A 133 ALA C C 13 172.524 0.400 A 133 ALA CA C 13 49.623 0.400 A 133 ALA CB C 13 21.496 0.400 A 133 ALA N N 15 124.000 0.400 A 134 ARG H H 1 7.584 0.020 A 134 ARG HA H 1 4.793 0.020 A 134 ARG HDx H 1 2.808 0.020 A 134 ARG HDy H 1 2.808 0.020 A 134 ARG HE H 1 8.368 0.020 A 134 ARG HGx H 1 1.420 0.020 A 134 ARG HGy H 1 1.420 0.020 A 134 ARG C C 13 169.878 0.400 A 134 ARG CA C 13 53.935 0.400 A 134 ARG CB C 13 29.432 0.400 A 134 ARG CD C 13 40.508 0.400 A 134 ARG CG C 13 28.074 0.400 A 134 ARG N N 15 118.375 0.400 A 135 TYR H H 1 8.703 0.020 A 135 TYR HA H 1 5.770 0.020 A 135 TYR HBy H 1 2.805 0.020 A 135 TYR HBx H 1 2.510 0.020 A 135 TYR C C 13 173.531 0.400 A 135 TYR CA C 13 52.569 0.400 A 135 TYR CB C 13 40.260 0.400 A 135 TYR N N 15 114.631 0.400 A 136 VAL H H 1 9.028 0.020 A 136 VAL HA H 1 5.143 0.020 A 136 VAL HB H 1 1.874 0.020 A 136 VAL HGx% H 1 1.104 0.020 A 136 VAL HGy% H 1 1.104 0.020 A 136 VAL C C 13 171.686 0.400 A 136 VAL CA C 13 58.373 0.400 A 136 VAL CB C 13 33.997 0.400 A 136 VAL CG1 C 13 18.996 0.400 A 136 VAL CG2 C 13 18.996 0.400 A 136 VAL N N 15 120.250 0.400 A 137 ARG H H 1 9.607 0.020 A 137 ARG HA H 1 5.674 0.020 A 137 ARG HBx H 1 1.172 0.020 A 137 ARG HBy H 1 1.172 0.020 A 137 ARG HGx H 1 1.049 0.020 A 137 ARG HGy H 1 1.049 0.020 A 137 ARG C C 13 172.376 0.400 A 137 ARG CA C 13 51.498 0.400 A 137 ARG CB C 13 33.060 0.400 A 137 ARG CD C 13 39.690 0.400 A 137 ARG CG C 13 25.838 0.400 A 137 ARG N N 15 125.250 0.400 A 138 VAL H H 1 8.708 0.020 A 138 VAL HA H 1 4.321 0.020 A 138 VAL HB H 1 1.727 0.020 A 138 VAL HGx% H 1 0.575 0.020 A 138 VAL HGy% H 1 0.701 0.020 A 138 VAL C C 13 171.779 0.400 A 138 VAL CA C 13 59.623 0.400 A 138 VAL CB C 13 30.247 0.400 A 138 VAL CG1 C 13 18.371 0.400 A 138 VAL CG2 C 13 19.001 0.400 A 138 VAL N N 15 121.188 0.400 A 139 LEU H H 1 8.806 0.020 A 139 LEU HA H 1 4.226 0.020 A 139 LEU HBx H 1 1.459 0.020 A 139 LEU HBy H 1 1.459 0.020 A 139 LEU HDx% H 1 1.023 0.020 A 139 LEU HDy% H 1 1.023 0.020 A 139 LEU CA C 13 48.621 0.400 A 139 LEU CB C 13 38.177 0.400 A 139 LEU N N 15 127.200 0.400 A 140 PRO HA H 1 4.465 0.020 A 140 PRO HBy H 1 1.999 0.020 A 140 PRO HBx H 1 1.975 0.020 A 140 PRO HDx H 1 3.071 0.020 A 140 PRO HDy H 1 3.071 0.020 A 140 PRO HGx H 1 1.875 0.020 A 140 PRO HGy H 1 1.875 0.020 A 140 PRO C C 13 172.968 0.400 A 140 PRO CA C 13 61.286 0.400 A 140 PRO CB C 13 30.337 0.400 A 141 VAL H H 1 9.072 0.020 A 141 VAL HA H 1 4.267 0.020 A 141 VAL HB H 1 1.945 0.020 A 141 VAL HGx% H 1 0.793 0.020 A 141 VAL HGy% H 1 1.112 0.020 A 141 VAL C C 13 172.048 0.400 A 141 VAL CA C 13 60.873 0.400 A 141 VAL CB C 13 30.872 0.400 A 141 VAL CG1 C 13 18.996 0.400 A 141 VAL CG2 C 13 20.246 0.400 A 141 VAL N N 15 124.000 0.400 A 142 SER H H 1 7.938 0.020 A 142 SER HA H 1 3.739 0.020 A 142 SER HBy H 1 3.553 0.020 A 142 SER HBx H 1 3.451 0.020 A 142 SER C C 13 171.417 0.400 A 142 SER CA C 13 54.550 0.400 A 142 SER CB C 13 63.030 0.400 A 142 SER N N 15 111.753 0.400 A 143 TRP H H 1 7.892 0.020 A 143 TRP HA H 1 5.193 0.020 A 143 TRP HBy H 1 3.276 0.020 A 143 TRP HBx H 1 2.809 0.020 A 143 TRP HD1 H 1 6.787 0.020 A 143 TRP HE1 H 1 9.892 0.020 A 143 TRP HZ3 H 1 6.437 0.020 A 143 TRP C C 13 169.612 0.400 A 143 TRP CA C 13 53.373 0.400 A 143 TRP CB C 13 27.747 0.400 A 143 TRP N N 15 118.688 0.400 A 144 HIS H H 1 8.910 0.020 A 144 HIS HA H 1 4.419 0.020 A 144 HIS HBy H 1 3.814 0.020 A 144 HIS HBx H 1 3.427 0.020 A 144 HIS C C 13 172.754 0.400 A 144 HIS CA C 13 52.380 0.400 A 144 HIS CB C 13 27.232 0.400 A 144 HIS N N 15 120.563 0.400 A 145 ASN H H 1 8.834 0.020 A 145 ASN HA H 1 3.817 0.020 A 145 ASN HBy H 1 3.427 0.020 A 145 ASN HBx H 1 2.490 0.020 A 145 ASN C C 13 172.802 0.400 A 145 ASN CA C 13 55.790 0.400 A 145 ASN CB C 13 33.860 0.400 A 145 ASN N N 15 120.234 0.400 A 146 ARG H H 1 8.857 0.020 A 146 ARG HA H 1 4.284 0.020 A 146 ARG HBx H 1 1.054 0.020 A 146 ARG HBy H 1 1.054 0.020 A 146 ARG HDx H 1 2.259 0.020 A 146 ARG HDy H 1 2.259 0.020 A 146 ARG HE H 1 6.447 0.020 A 146 ARG HGy H 1 0.840 0.020 A 146 ARG HGx H 1 0.759 0.020 A 146 ARG C C 13 170.460 0.400 A 146 ARG CA C 13 52.088 0.400 A 146 ARG CB C 13 32.910 0.400 A 146 ARG CD C 13 39.861 0.400 A 146 ARG CG C 13 25.740 0.400 A 146 ARG N N 15 120.345 0.400 A 147 ILE H H 1 6.456 0.020 A 147 ILE HA H 1 3.092 0.020 A 147 ILE HB H 1 0.977 0.020 A 147 ILE HD1% H 1 -0.047 0.020 A 147 ILE HG1x H 1 -0.001 0.020 A 147 ILE HG1y H 1 0.331 0.020 A 147 ILE HG2% H 1 0.427 0.020 A 147 ILE C C 13 169.144 0.400 A 147 ILE CA C 13 58.998 0.400 A 147 ILE CB C 13 34.622 0.400 A 147 ILE CD1 C 13 11.496 0.400 A 147 ILE CG1 C 13 25.871 0.400 A 147 ILE CG2 C 13 16.496 0.400 A 147 ILE N N 15 117.125 0.400 A 148 THR H H 1 5.970 0.020 A 148 THR HA H 1 5.250 0.020 A 148 THR HB H 1 2.948 0.020 A 148 THR HG2% H 1 0.800 0.020 A 148 THR C C 13 170.209 0.400 A 148 THR CA C 13 57.748 0.400 A 148 THR CB C 13 69.624 0.400 A 148 THR CG2 C 13 22.121 0.400 A 148 THR N N 15 126.813 0.400 A 149 LEU H H 1 9.256 0.020 A 149 LEU HA H 1 3.699 0.020 A 149 LEU HBy H 1 1.712 0.020 A 149 LEU HBx H 1 1.711 0.020 A 149 LEU HDx% H 1 0.982 0.020 A 149 LEU HDy% H 1 0.871 0.020 A 149 LEU HG H 1 1.622 0.020 A 149 LEU C C 13 172.607 0.400 A 149 LEU CA C 13 51.640 0.400 A 149 LEU CB C 13 47.818 0.400 A 149 LEU CD1 C 13 23.371 0.400 A 149 LEU CD2 C 13 22.746 0.400 A 149 LEU CG C 13 23.574 0.400 A 149 LEU N N 15 123.766 0.400 A 150 ARG H H 1 8.576 0.020 A 150 ARG HA H 1 3.825 0.020 A 150 ARG HBx H 1 1.949 0.020 A 150 ARG HBy H 1 1.949 0.020 A 150 ARG HGy H 1 1.625 0.020 A 150 ARG HGx H 1 1.497 0.020 A 150 ARG C C 13 172.255 0.400 A 150 ARG CA C 13 54.072 0.400 A 150 ARG CB C 13 33.362 0.400 A 150 ARG CG C 13 25.403 0.400 A 150 ARG N N 15 120.868 0.400 A 151 LEU H H 1 7.711 0.020 A 151 LEU HA H 1 5.327 0.020 A 151 LEU HBy H 1 1.715 0.020 A 151 LEU HBx H 1 1.325 0.020 A 151 LEU C C 13 172.753 0.400 A 151 LEU CA C 13 52.052 0.400 A 151 LEU CB C 13 45.176 0.400 A 151 LEU N N 15 120.471 0.400 A 152 GLU H H 1 8.877 0.020 A 152 GLU HA H 1 4.408 0.020 A 152 GLU HBx H 1 1.731 0.020 A 152 GLU HBy H 1 1.731 0.020 A 152 GLU HGx H 1 2.059 0.020 A 152 GLU HGy H 1 2.059 0.020 A 152 GLU C C 13 171.389 0.400 A 152 GLU CA C 13 52.440 0.400 A 152 GLU CB C 13 33.990 0.400 A 152 GLU CG C 13 33.572 0.400 A 152 GLU N N 15 120.250 0.400 A 153 LEU H H 1 9.110 0.020 A 153 LEU HA H 1 5.047 0.020 A 153 LEU HBy H 1 1.537 0.020 A 153 LEU HBx H 1 1.409 0.020 A 153 LEU HDx% H 1 1.009 0.020 A 153 LEU HDy% H 1 0.858 0.020 A 153 LEU HG H 1 1.309 0.020 A 153 LEU C C 13 171.438 0.400 A 153 LEU CA C 13 50.437 0.400 A 153 LEU CB C 13 44.175 0.400 A 153 LEU CD1 C 13 24.045 0.400 A 153 LEU CD2 C 13 24.045 0.400 A 153 LEU CG C 13 28.022 0.400 A 153 LEU N N 15 126.250 0.400 A 154 LEU H H 1 8.016 0.020 A 154 LEU HA H 1 5.106 0.020 A 154 LEU HBy H 1 1.071 0.020 A 154 LEU HBx H 1 0.693 0.020 A 154 LEU HDx% H 1 0.474 0.020 A 154 LEU HDy% H 1 0.451 0.020 A 154 LEU HG H 1 1.466 0.020 A 154 LEU C C 13 173.932 0.400 A 154 LEU CA C 13 48.998 0.400 A 154 LEU CB C 13 41.497 0.400 A 154 LEU CD1 C 13 22.746 0.400 A 154 LEU CD2 C 13 18.996 0.400 A 154 LEU CG C 13 26.496 0.400 A 154 LEU N N 15 119.938 0.400 A 155 GLY H H 1 8.995 0.020 A 155 GLY HAy H 1 4.544 0.020 A 155 GLY HAx H 1 4.321 0.020 A 155 GLY C C 13 169.525 0.400 A 155 GLY CA C 13 44.622 0.400 A 155 GLY N N 15 108.063 0.400 A 156 CYS H H 1 8.206 0.020 A 156 CYS HA H 1 5.056 0.020 A 156 CYS HBy H 1 3.197 0.020 A 156 CYS HBx H 1 2.927 0.020 A 156 CYS C C 13 171.731 0.400 A 156 CYS CA C 13 52.123 0.400 A 156 CYS CB C 13 39.080 0.400 A 156 CYS N N 15 116.188 0.400 A 157 LEU H H 1 8.511 0.020 A 157 LEU HA H 1 4.230 0.020 A 157 LEU HBx H 1 1.404 0.020 A 157 LEU HBy H 1 1.404 0.020 A 157 LEU HDx% H 1 0.770 0.020 A 157 LEU HDy% H 1 0.724 0.020 A 157 LEU HG H 1 1.376 0.020 A 157 LEU C C 13 173.587 0.400 A 157 LEU CA C 13 52.123 0.400 A 157 LEU CB C 13 40.247 0.400 A 157 LEU CD1 C 13 22.121 0.400 A 157 LEU CD2 C 13 20.871 0.400 A 157 LEU CG C 13 23.996 0.400 A 157 LEU N N 15 124.938 0.400 A 158 GLU H H 1 8.157 0.020 A 158 GLU HA H 1 4.125 0.020 A 158 GLU HBy H 1 1.788 0.020 A 158 GLU HBx H 1 1.729 0.020 A 158 GLU HGx H 1 2.049 0.020 A 158 GLU HGy H 1 2.049 0.020 A 158 GLU CA C 13 53.373 0.400 A 158 GLU CB C 13 27.747 0.400 A 158 GLU CG C 13 33.372 0.400 A 158 GLU N N 15 120.875 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 124 LYS H A 124 LYS HGx 1.0 . 5.50 2 2 A 124 LYS H A 124 LYS HGy 1.0 . 5.50 3 3 A 22 SER HA A 49 TRP HE1 1.0 . 3.68 4 4 A 49 TRP HE1 A 19 ALA HB% 1.0 . 3.42 5 5 A 93 ALA HA A 104 TYR H 1.0 . 4.87 6 6 A 105 GLU H A 105 GLU HBx 1.0 . 3.66 7 7 A 113 PHE H A 112 VAL HGy% 1.0 . 4.87 8 8 A 111 LYS H A 110 SER HBx 1.0 . 5.12 9 9 A 111 LYS H A 110 SER HBy 1.0 . 5.12 10 10 A 111 LYS H A 111 LYS HGx 1.0 . 5.36 11 11 A 111 LYS H A 111 LYS HGy 1.0 . 5.36 12 12 A 59 TRP HA A 139 LEU H 1.0 . 5.28 13 13 A 139 LEU H A 91 LYS HBx 1.0 . 5.17 14 14 A 139 LEU H A 91 LYS HBy 1.0 . 5.17 15 15 A 60 LEU HBx A 61 GLN H 1.0 . 4.34 16 16 A 61 GLN H A 60 LEU HBy 1.0 . 4.40 17 17 A 93 ALA H A 136 VAL HB 1.0 . 5.12 18 18 A 63 ASP HA A 134 ARG HE 1.0 . 4.79 19 19 A 153 LEU H A 152 GLU HGx 1.0 . 5.50 20 20 A 153 LEU H A 152 GLU HGy 1.0 . 5.50 21 21 A 96 ASP H A 133 ALA HB% 1.0 . 4.97 22 22 A 127 PHE H A 72 GLY HAy 1.0 . 5.10 23 23 A 127 PHE H A 126 ILE HB 1.0 . 4.04 24 24 A 127 PHE H A 71 THR HG2% 1.0 . 4.72 25 25 A 127 PHE H A 126 ILE HD1% 1.0 . 4.34 26 26 A 153 LEU H A 73 ILE HG2% 1.0 . 5.42 27 27 A 23 TYR H A 22 SER HBy 1.0 . 4.27 28 28 A 23 TYR H A 51 ALA HA 1.0 . 4.73 29 29 A 80 ASP HA A 81 PHE H 1.0 . 3.52 30 30 A 157 LEU H A 3 GLU HGy 1.0 . 5.50 31 31 A 157 LEU H A 3 GLU HGx 1.0 . 5.50 32 32 A 49 TRP HBy A 50 THR H 1.0 . 4.23 33 33 A 39 ARG HBx A 40 LEU H 1.0 . 4.07 34 34 A 40 LEU H A 7 LEU HDx% 1.0 . 4.81 35 35 A 40 LEU H A 7 LEU HDy% 1.0 . 4.81 36 36 A 7 LEU H A 7 LEU HG 1.0 . 3.81 37 37 A 7 LEU H A 7 LEU HBx 1.0 . 3.98 38 38 A 7 LEU H A 7 LEU HDy% 1.0 . 4.65 39 39 A 64 LEU H A 135 TYR HA 1.0 . 4.67 40 40 A 64 LEU H A 64 LEU HG 1.0 . 4.26 41 41 A 141 VAL H A 90 TYR HBx 1.0 . 5.50 42 42 A 141 VAL H A 90 TYR HBy 1.0 . 5.50 43 43 A 76 GLN H A 151 LEU HA 1.0 . 4.90 44 44 A 12 ILE H A 12 ILE HG1x 1.0 . 4.22 45 45 A 12 ILE H A 12 ILE HG1y 1.0 . 4.22 46 46 A 7 LEU H A 5 LEU HA 1.0 . 5.50 47 47 A 69 GLN HA A 133 ALA H 1.0 . 4.02 48 48 A 133 ALA H A 132 MET HBy 1.0 . 4.61 49 49 A 133 ALA H A 132 MET HBx 1.0 . 4.61 50 50 A 62 VAL H A 137 ARG HA 1.0 . 4.22 51 51 A 62 VAL H A 136 VAL HGy% 1.0 . 4.74 52 52 A 122 HIS H A 123 LYS HA 1.0 . 5.32 53 53 A 122 HIS H A 74 ILE HD1% 1.0 . 4.95 54 54 A 3 GLU H A 154 LEU HA 1.0 . 4.10 55 55 A 3 GLU H A 154 LEU HBy 1.0 . 4.88 56 56 A 3 GLU H A 4 PRO HDy 1.0 . 5.50 57 57 A 3 GLU H A 4 PRO HDx 1.0 . 5.50 58 58 A 3 GLU H A 155 GLY HAy 1.0 . 4.74 59 59 A 74 ILE HD1% A 123 LYS H 1.0 . 3.71 60 60 A 123 LYS H A 122 HIS HBx 1.0 . 4.44 61 61 A 123 LYS H A 123 LYS HGx 1.0 . 5.50 62 62 A 123 LYS H A 123 LYS HGy 1.0 . 5.50 63 63 A 7 LEU HBy A 8 LYS H 1.0 . 4.11 64 64 A 8 LYS H A 4 PRO HGy 1.0 . 3.98 65 65 A 5 LEU H A 5 LEU HBy 1.0 . 3.99 66 66 A 5 LEU H A 5 LEU HDy% 1.0 . 3.78 67 67 A 87 VAL H A 86 TYR HBx 1.0 . 4.51 68 68 A 14 ASP HA A 17 MET H 1.0 . 4.75 69 69 A 17 MET H A 15 SER HA 1.0 . 5.10 70 70 A 51 ALA HB% A 52 GLN H 1.0 . 4.04 71 71 A 150 ARG H A 149 LEU HDy% 1.0 . 4.46 72 72 A 52 GLN H A 23 TYR HA 1.0 . 5.43 73 73 A 52 GLN H A 52 GLN HGy 1.0 . 5.50 74 74 A 52 GLN H A 52 GLN HGx 1.0 . 5.50 75 75 A 69 GLN H A 68 ARG HDx 1.0 . 4.26 76 76 A 97 ASP HA A 99 VAL H 1.0 . 5.09 77 77 A 95 SER HA A 100 GLN H 1.0 . 4.81 78 78 A 100 GLN H A 99 VAL HB 1.0 . 4.17 79 79 A 13 PRO HGx A 14 ASP H 1.0 . 3.90 80 80 A 150 ARG H A 149 LEU HDx% 1.0 . 4.46 81 81 A 157 LEU HA A 158 GLU H 1.0 . 3.02 82 82 A 158 GLU H A 158 GLU HGx 1.0 . 5.41 83 83 A 158 GLU H A 158 GLU HGy 1.0 . 5.41 84 84 A 75 THR HA A 152 GLU H 1.0 . 4.47 85 85 A 146 ARG H A 147 ILE HD1% 1.0 . 4.99 86 86 A 126 ILE H A 125 ASN HBy 1.0 . 4.11 87 87 A 126 ILE H A 125 ASN HBx 1.0 . 4.11 88 88 A 153 LEU HG A 154 LEU H 1.0 . 4.89 89 89 A 67 GLN H A 67 GLN HBx 1.0 . 3.82 90 90 A 152 GLU H A 152 GLU HGx 1.0 . 5.50 91 91 A 152 GLU H A 152 GLU HGy 1.0 . 5.50 92 92 A 88 ALA HB% A 116 ASN H 1.0 . 4.79 93 93 A 154 LEU H A 153 LEU HBx 1.0 . 4.12 94 94 A 154 LEU H A 70 VAL HB 1.0 . 4.13 95 95 A 154 LEU HBy A 154 LEU H 1.0 . 3.73 96 96 A 154 LEU H A 154 LEU HG 1.0 . 4.46 97 97 A 78 ALA H A 86 TYR HA 1.0 . 4.25 98 98 A 78 ALA H A 148 THR HG2% 1.0 . 4.23 99 99 A 58 GLU H A 57 LYS HGx 1.0 . 5.50 100 100 A 58 GLU H A 57 LYS HGy 1.0 . 5.50 101 101 A 147 ILE HD1% A 58 GLU H 1.0 . 5.50 102 102 A 60 LEU H A 60 LEU HDy% 1.0 . 5.23 103 103 A 143 TRP H A 142 SER HBx 1.0 . 4.24 104 104 A 19 ALA H A 35 PRO HGx 1.0 . 4.01 105 105 A 134 ARG H A 134 ARG HGx 1.0 . 5.45 106 106 A 134 ARG H A 134 ARG HGy 1.0 . 5.45 107 107 A 148 THR HG2% A 79 ARG H 1.0 . 4.98 108 108 A 57 LYS H A 55 SER HBx 1.0 . 4.44 109 109 A 90 TYR H A 113 PHE HBy 1.0 . 5.41 110 110 A 90 TYR H A 113 PHE HBx 1.0 . 5.41 111 111 A 73 ILE H A 73 ILE HD1% 1.0 . 3.81 112 112 A 97 ASP H A 98 GLY HAx 1.0 . 5.07 113 113 A 97 ASP H A 98 GLY HAy 1.0 . 4.76 114 114 A 95 SER HA A 97 ASP H 1.0 . 4.17 115 115 A 94 HIS H A 101 TRP HA 1.0 . 4.40 116 116 A 69 GLN HBy A 156 CYS H 1.0 . 4.45 117 117 A 49 TRP H A 78 ALA HB% 1.0 . 5.50 118 118 A 46 ILE H A 46 ILE HG1y 1.0 . 3.84 119 119 A 156 CYS H A 156 CYS HBx 1.0 . 3.78 120 120 A 71 THR HG2% A 156 CYS H 1.0 . 4.28 121 121 A 18 SER H A 35 PRO HBx 1.0 . 4.43 122 122 A 18 SER H A 35 PRO HGy 1.0 . 5.50 123 123 A 18 SER H A 62 VAL HGx% 1.0 . 5.50 124 124 A 18 SER H A 62 VAL HGy% 1.0 . 5.50 125 125 A 20 SER H A 60 LEU HA 1.0 . 4.43 126 126 A 135 TYR H A 135 TYR HBx 1.0 . 4.14 127 127 A 70 VAL HGx% A 71 THR H 1.0 . 4.12 128 128 A 88 ALA HB% A 89 SER H 1.0 . 3.11 129 129 A 89 SER H A 87 VAL HA 1.0 . 5.09 130 130 A 118 ASP HA A 120 ASN H 1.0 . 4.48 131 131 A 120 ASN H A 120 ASN HBy 1.0 . 3.83 132 132 A 109 SER H A 107 GLN HBx 1.0 . 5.50 133 133 A 109 SER H A 107 GLN HBy 1.0 . 5.50 134 134 A 95 SER H A 136 VAL HGx% 1.0 . 4.46 135 135 A 133 ALA HB% A 95 SER H 1.0 . 3.76 136 136 A 101 TRP HA A 95 SER H 1.0 . 5.05 137 137 A 9 ASN H A 10 ASN HA 1.0 . 4.62 138 138 A 21 SER H A 21 SER HBx 1.0 . 4.14 139 139 A 21 SER H A 52 GLN HBx 1.0 . 4.71 140 140 A 19 ALA HB% A 21 SER H 1.0 . 3.20 141 141 A 90 TYR HA A 142 SER H 1.0 . 4.88 142 142 A 142 SER H A 140 PRO HA 1.0 . 4.18 143 143 A 142 SER H A 141 VAL HGy% 1.0 . 3.90 144 144 A 100 GLN HBy A 100 GLN HE2x 1.0 . 4.60 145 145 A 63 ASP HA A 65 GLY H 1.0 . 4.29 146 146 A 65 GLY H A 66 THR HG2% 1.0 . 4.51 147 147 A 59 TRP H A 59 TRP HBy 1.0 . 4.04 148 148 A 60 LEU HBy A 59 TRP H 1.0 . 5.36 149 149 A 72 GLY H A 153 LEU HA 1.0 . 5.50 150 150 A 154 LEU HA A 72 GLY H 1.0 . 5.50 151 151 A 72 GLY H A 70 VAL HGy% 1.0 . 3.81 152 152 A 9 ASN HA A 10 ASN HD2x 1.0 . 4.86 153 153 A 10 ASN HD2x A 11 THR HG2% 1.0 . 5.50 154 154 A 10 ASN HD2y A 9 ASN HBy 1.0 . 4.72 155 155 A 10 ASN HD2y A 9 ASN HBx 1.0 . 4.72 156 156 A 154 LEU HA A 155 GLY H 1.0 . 3.36 157 157 A 155 GLY H A 154 LEU HDx% 1.0 . 4.81 158 158 A 155 GLY H A 154 LEU HDy% 1.0 . 4.81 159 159 A 43 GLN HA A 44 GLY H 1.0 . 3.56 160 160 A 44 GLY H A 43 GLN HGx 1.0 . 4.52 161 161 A 44 GLY H A 43 GLN HGy 1.0 . 4.52 162 162 A 36 HIS H A 37 LEU HDy% 1.0 . 4.96 163 163 A 22 SER HA A 51 ALA H 1.0 . 5.42 164 164 A 146 ARG HE A 146 ARG HBx 1.0 . 5.50 165 165 A 146 ARG HE A 146 ARG HBy 1.0 . 5.50 166 166 A 55 SER H A 54 ASN HBx 1.0 . 5.38 167 167 A 147 ILE HD1% A 55 SER H 1.0 . 3.42 168 168 A 20 SER H A 59 TRP HE1 1.0 . 4.38 169 169 A 95 SER H A 137 ARG H 1.0 . 4.85 170 170 A 137 ARG H A 94 HIS HD2 1.0 . 4.99 171 171 A 17 MET H A 18 SER H 1.0 . 4.66 172 172 A 20 SER H A 59 TRP H 1.0 . 4.32 173 173 A 52 GLN H A 21 SER H 1.0 . 5.13 174 174 A 58 GLU H A 59 TRP H 1.0 . 4.79 175 175 A 23 TYR H A 51 ALA H 1.0 . 4.12 176 176 A 143 TRP H A 143 TRP HD1 1.0 . 4.67 177 177 A 109 SER H A 106 GLU H 1.0 . 4.16 178 178 A 127 PHE HD% A 129 LYS H 1.0 . 5.25 179 179 A 49 TRP H A 48 ALA H 1.0 . 4.07 180 180 A 61 GLN H A 18 SER H 1.0 . 4.14 181 181 A 64 LEU H A 63 ASP H 1.0 . 4.73 182 182 A 95 SER H A 136 VAL H 1.0 . 5.10 183 183 A 49 TRP HE1 A 21 SER H 1.0 . 4.15 184 184 A 139 LEU H A 91 LYS H 1.0 . 4.32 185 185 A 48 ALA H A 37 LEU HDx% 1.0 . 4.35 186 186 A 51 ALA HB% A 53 SER H 1.0 . 3.46 187 187 A 102 THR HG2% A 103 VAL HA 1.0 . 4.71 188 188 A 101 TRP HA A 102 THR HG1 1.0 . 5.45 189 189 A 55 SER HA A 56 ALA HB% 1.0 . 4.52 190 190 A 2 SER HA A 154 LEU HDx% 1.0 . 4.85 191 191 A 2 SER HA A 154 LEU HDy% 1.0 . 4.85 192 192 A 57 LYS HA A 57 LYS HDx 1.0 . 5.46 193 193 A 57 LYS HA A 57 LYS HDy 1.0 . 5.46 194 194 A 116 ASN HA A 117 LEU HG 1.0 . 3.98 195 195 A 96 ASP HA A 134 ARG HGx 1.0 . 5.50 196 196 A 96 ASP HA A 134 ARG HGy 1.0 . 5.50 197 197 A 75 THR HG2% A 76 GLN HA 1.0 . 4.35 198 198 A 146 ARG HA A 146 ARG HGy 1.0 . 3.98 199 199 A 84 ILE HG2% A 85 GLN HA 1.0 . 4.14 200 200 A 125 ASN HA A 126 ILE HG2% 1.0 . 5.50 201 201 A 37 LEU HA A 37 LEU HDy% 1.0 . 4.09 202 202 A 66 THR HG2% A 68 ARG HDy 1.0 . 4.66 203 203 A 132 MET HA A 132 MET HE% 1.0 . 4.22 204 204 A 69 GLN HA A 132 MET HE% 1.0 . 4.52 205 205 A 71 THR HG2% A 130 PRO HGy 1.0 . 3.91 206 206 A 73 ILE HG2% A 70 VAL HGy% 1.0 . 4.54 207 207 A 73 ILE HG2% A 70 VAL HB 1.0 . 3.95 208 208 A 154 LEU HBy A 154 LEU HDx% 1.0 . 4.15 209 209 A 154 LEU HBy A 154 LEU HDy% 1.0 . 4.15 210 210 A 71 THR HG2% A 1 CYS HBx 1.0 . 5.50 211 211 A 71 THR HG2% A 1 CYS HBy 1.0 . 5.50 212 212 A 79 ARG HA A 79 ARG HDx 1.0 . 5.50 213 213 A 147 ILE HD1% A 58 GLU HBx 1.0 . 5.50 214 214 A 147 ILE HD1% A 58 GLU HBy 1.0 . 5.50 215 215 A 148 THR HG2% A 48 ALA H 1.0 . 4.81 216 216 A 93 ALA HB% A 101 TRP HD1 1.0 . 5.17 217 217 A 60 LEU H A 60 LEU HDx% 1.0 . 5.23 218 218 A 71 THR HG2% A 127 PHE HD% 1.0 . 4.22 219 219 A 104 TYR HA A 104 TYR HD% 1.0 . 4.69 220 220 A 23 TYR HA A 51 ALA H 1.0 . 5.18 221 221 A 5 LEU H A 4 PRO HA 1.0 . 3.39 222 222 A 5 LEU H A 5 LEU HDx% 1.0 . 3.78 223 223 A 5 LEU H A 5 LEU HBx 1.0 . 3.99 224 224 A 5 LEU H A 5 LEU HG 1.0 . 4.33 225 225 A 4 PRO HGy A 5 LEU H 1.0 . 4.22 226 226 A 5 LEU HA A 6 GLY H 1.0 . 3.44 227 227 A 6 GLY H A 5 LEU HBx 1.0 . 5.14 228 228 A 5 LEU HG A 6 GLY H 1.0 . 5.50 229 229 A 6 GLY H A 5 LEU HDy% 1.0 . 4.74 230 230 A 7 LEU H A 7 LEU HDx% 1.0 . 4.65 231 231 A 7 LEU H A 8 LYS H 1.0 . 3.58 232 232 A 8 LYS H A 5 LEU H 1.0 . 5.50 233 233 A 7 LEU HBx A 8 LYS H 1.0 . 4.56 234 234 A 8 LYS H A 10 ASN H 1.0 . 5.04 235 235 A 12 ILE H A 10 ASN H 1.0 . 5.07 236 236 A 10 ASN HA A 10 ASN H 1.0 . 2.86 237 237 A 10 ASN H A 9 ASN HBx 1.0 . 4.71 238 238 A 11 THR HG2% A 10 ASN H 1.0 . 4.27 239 239 A 15 SER H A 16 GLN H 1.0 . 3.47 240 240 A 15 SER H A 13 PRO HA 1.0 . 4.45 241 241 A 13 PRO HGx A 15 SER H 1.0 . 3.14 242 242 A 17 MET H A 16 GLN HGy 1.0 . 3.70 243 243 A 17 MET H A 16 GLN HGx 1.0 . 3.70 244 244 A 18 SER H A 17 MET HA 1.0 . 3.08 245 245 A 18 SER H A 62 VAL HA 1.0 . 3.68 246 246 A 61 GLN H A 19 ALA HA 1.0 . 4.10 247 247 A 61 GLN H A 60 LEU HG 1.0 . 4.89 248 248 A 20 SER H A 19 ALA HA 1.0 . 3.21 249 249 A 20 SER H A 20 SER HBx 1.0 . 4.14 250 250 A 20 SER H A 20 SER HBy 1.0 . 4.14 251 251 A 20 SER H A 21 SER H 1.0 . 3.22 252 252 A 21 SER H A 21 SER HBy 1.0 . 4.14 253 253 A 21 SER HA A 22 SER H 1.0 . 3.19 254 254 A 22 SER H A 21 SER HBy 1.0 . 4.07 255 255 A 22 SER H A 21 SER HBx 1.0 . 4.07 256 256 A 53 SER HA A 54 ASN HD2x 1.0 . 3.97 257 257 A 111 LYS H A 105 GLU HA 1.0 . 3.57 258 258 A 111 LYS H A 110 SER HA 1.0 . 3.27 259 259 A 95 SER HA A 101 TRP H 1.0 . 5.12 260 260 A 101 TRP H A 101 TRP HBx 1.0 . 3.82 261 261 A 141 VAL H A 91 LYS H 1.0 . 4.96 262 262 A 140 PRO HA A 91 LYS H 1.0 . 4.27 263 263 A 91 LYS H A 138 VAL HA 1.0 . 5.37 264 264 A 91 LYS H A 92 VAL H 1.0 . 4.91 265 265 A 123 LYS H A 74 ILE HA 1.0 . 5.25 266 266 A 123 LYS H A 122 HIS HA 1.0 . 3.31 267 267 A 123 LYS H A 122 HIS HBy 1.0 . 4.44 268 268 A 123 LYS H A 75 THR H 1.0 . 4.46 269 269 A 75 THR H A 74 ILE H 1.0 . 4.79 270 270 A 151 LEU HA A 74 ILE H 1.0 . 5.05 271 271 A 155 GLY HAy A 72 GLY H 1.0 . 4.40 272 272 A 72 GLY H A 70 VAL HA 1.0 . 4.08 273 273 A 72 GLY H A 71 THR HB 1.0 . 4.09 274 274 A 133 ALA H A 68 ARG H 1.0 . 3.53 275 275 A 125 ASN H A 124 LYS HBx 1.0 . 5.16 276 276 A 125 ASN H A 124 LYS HBy 1.0 . 5.16 277 277 A 43 GLN H A 43 GLN HBy 1.0 . 3.60 278 278 A 106 GLU H A 110 SER HA 1.0 . 3.72 279 279 A 55 SER H A 56 ALA H 1.0 . 4.72 280 280 A 57 LYS H A 55 SER H 1.0 . 4.69 281 281 A 55 SER H A 54 ASN HA 1.0 . 3.21 282 282 A 55 SER H A 54 ASN HBy 1.0 . 5.38 283 283 A 48 ALA H A 47 ASN H 1.0 . 3.69 284 284 A 116 ASN HA A 118 ASP H 1.0 . 4.52 285 285 A 41 ASP H A 42 ASN HA 1.0 . 5.41 286 286 A 92 VAL H A 92 VAL HGx% 1.0 . 4.00 287 287 A 104 TYR H A 103 VAL HB 1.0 . 4.16 288 288 A 95 SER H A 136 VAL HA 1.0 . 4.16 289 289 A 135 TYR H A 96 ASP HA 1.0 . 5.09 290 290 A 135 TYR H A 136 VAL HA 1.0 . 5.50 291 291 A 133 ALA HB% A 135 TYR H 1.0 . 3.56 292 292 A 135 TYR H A 135 TYR HBy 1.0 . 4.14 293 293 A 137 ARG H A 94 HIS HA 1.0 . 4.13 294 294 A 62 VAL H A 138 VAL H 1.0 . 5.50 295 295 A 138 VAL H A 61 GLN HA 1.0 . 4.50 296 296 A 139 LEU H A 138 VAL HGy% 1.0 . 4.04 297 297 A 141 VAL H A 142 SER H 1.0 . 3.24 298 298 A 142 SER H A 141 VAL HB 1.0 . 3.38 299 299 A 142 SER H A 141 VAL HGx% 1.0 . 3.90 300 300 A 67 GLN H A 67 GLN HBy 1.0 . 3.82 301 301 A 49 TRP H A 148 THR HA 1.0 . 5.50 302 302 A 76 GLN H A 75 THR HG1 1.0 . 4.53 303 303 A 63 ASP H A 17 MET HA 1.0 . 4.43 304 304 A 63 ASP H A 62 VAL HB 1.0 . 4.13 305 305 A 107 GLN H A 107 GLN HGx 1.0 . 5.12 306 306 A 107 GLN H A 107 GLN HGy 1.0 . 5.12 307 307 A 56 ALA H A 143 TRP HZ3 1.0 . 5.22 308 308 A 122 HIS H A 122 HIS HBy 1.0 . 3.72 309 309 A 122 HIS H A 121 SER HBx 1.0 . 5.13 310 310 A 122 HIS H A 121 SER HBy 1.0 . 5.13 311 311 A 78 ALA H A 79 ARG H 1.0 . 4.41 312 312 A 79 ARG H A 84 ILE HA 1.0 . 5.12 313 313 A 143 TRP H A 144 HIS H 1.0 . 4.43 314 314 A 143 TRP H A 142 SER HBy 1.0 . 4.24 315 315 A 114 GLN H A 115 GLY H 1.0 . 4.62 316 316 A 129 LYS H A 129 LYS HGx 1.0 . 4.62 317 317 A 129 LYS H A 129 LYS HGy 1.0 . 4.62 318 318 A 129 LYS H A 127 PHE HA 1.0 . 4.66 319 319 A 116 ASN H A 117 LEU H 1.0 . 4.52 320 320 A 114 GLN H A 114 GLN HGx 1.0 . 4.82 321 321 A 114 GLN H A 114 GLN HGy 1.0 . 4.82 322 322 A 57 LYS H A 55 SER HBy 1.0 . 4.44 323 323 A 82 GLY H A 83 HIS HA 1.0 . 5.27 324 324 A 38 GLY H A 48 ALA HB% 1.0 . 5.50 325 325 A 60 LEU H A 59 TRP H 1.0 . 5.11 326 326 A 77 GLY H A 119 ASN HA 1.0 . 4.78 327 327 A 77 GLY H A 76 GLN HBx 1.0 . 4.99 328 328 A 77 GLY H A 76 GLN HBy 1.0 . 4.99 329 329 A 155 GLY H A 154 LEU HBx 1.0 . 3.84 330 330 A 69 GLN H A 157 LEU HA 1.0 . 4.91 331 331 A 69 GLN H A 68 ARG HDy 1.0 . 4.26 332 332 A 69 GLN H A 69 GLN HBy 1.0 . 3.11 333 333 A 69 GLN H A 68 ARG HBy 1.0 . 4.74 334 334 A 69 GLN H A 68 ARG HBx 1.0 . 4.74 335 335 A 71 THR H A 70 VAL H 1.0 . 4.87 336 336 A 88 ALA H A 143 TRP HBy 1.0 . 4.96 337 337 A 79 ARG HA A 85 GLN H 1.0 . 3.75 338 338 A 85 GLN H A 85 GLN HBy 1.0 . 4.03 339 339 A 84 ILE HG2% A 85 GLN H 1.0 . 3.82 340 340 A 148 THR HG2% A 85 GLN H 1.0 . 5.50 341 341 A 85 GLN H A 148 THR HG1 1.0 . 5.50 342 342 A 40 LEU H A 39 ARG HA 1.0 . 3.49 343 343 A 40 LEU H A 40 LEU HBx 1.0 . 4.08 344 344 A 40 LEU H A 40 LEU HBy 1.0 . 4.08 345 345 A 23 TYR H A 50 THR H 1.0 . 4.27 346 346 A 66 THR H A 134 ARG HA 1.0 . 4.20 347 347 A 66 THR H A 66 THR HB 1.0 . 3.69 348 348 A 10 ASN HD2x A 9 ASN HBx 1.0 . 3.67 349 349 A 10 ASN HD2x A 9 ASN HBy 1.0 . 3.67 350 350 A 9 ASN H A 10 ASN HD2x 1.0 . 4.87 351 351 A 109 SER H A 107 GLN H 1.0 . 4.65 352 352 A 109 SER H A 107 GLN HGx 1.0 . 4.35 353 353 A 109 SER H A 107 GLN HGy 1.0 . 4.35 354 354 A 60 LEU H A 139 LEU HA 1.0 . 4.65 355 355 A 60 LEU H A 59 TRP HBx 1.0 . 4.02 356 356 A 60 LEU HBx A 60 LEU H 1.0 . 4.11 357 357 A 60 LEU HBy A 60 LEU H 1.0 . 3.72 358 358 A 37 LEU H A 37 LEU HDx% 1.0 . 3.92 359 359 A 52 GLN H A 51 ALA H 1.0 . 4.83 360 360 A 147 ILE HD1% A 51 ALA H 1.0 . 4.51 361 361 A 132 MET H A 132 MET HBy 1.0 . 4.16 362 362 A 132 MET H A 132 MET HBx 1.0 . 4.16 363 363 A 132 MET H A 69 GLN HBx 1.0 . 3.86 364 364 A 22 SER HA A 52 GLN H 1.0 . 3.69 365 365 A 150 ARG H A 149 LEU H 1.0 . 4.98 366 366 A 18 SER H A 17 MET HGx 1.0 . 5.38 367 367 A 18 SER H A 17 MET HGy 1.0 . 5.38 368 368 A 62 VAL H A 63 ASP H 1.0 . 4.51 369 369 A 137 ARG H A 136 VAL H 1.0 . 4.89 370 370 A 63 ASP HA A 136 VAL H 1.0 . 5.37 371 371 A 136 VAL H A 135 TYR HBx 1.0 . 4.51 372 372 A 144 HIS H A 143 TRP HBx 1.0 . 3.84 373 373 A 87 VAL HA A 144 HIS H 1.0 . 4.18 374 374 A 144 HIS H A 86 TYR H 1.0 . 4.00 375 375 A 100 GLN H A 99 VAL HGy% 1.0 . 3.97 376 376 A 108 GLY H A 109 SER HA 1.0 . 5.26 377 377 A 54 ASN HD2x A 54 ASN HA 1.0 . 4.68 378 378 A 53 SER HA A 54 ASN HD2y 1.0 . 3.95 379 379 A 100 GLN HBy A 100 GLN HE2y 1.0 . 4.60 380 380 A 89 SER H A 142 SER H 1.0 . 3.68 381 381 A 155 GLY HAy A 71 THR H 1.0 . 4.06 382 382 A 45 LYS H A 45 LYS HGy 1.0 . 4.58 383 383 A 45 LYS H A 45 LYS HGx 1.0 . 4.58 384 384 A 42 ASN H A 42 ASN HBy 1.0 . 3.72 385 385 A 147 ILE H A 148 THR H 1.0 . 4.35 386 386 A 148 THR H A 148 THR HB 1.0 . 3.63 387 387 A 148 THR H A 149 LEU HA 1.0 . 4.93 388 388 A 51 ALA HB% A 147 ILE H 1.0 . 3.69 389 389 A 146 ARG H A 86 TYR H 1.0 . 4.11 390 390 A 116 ASN H A 88 ALA HA 1.0 . 3.74 391 391 A 116 ASN H A 116 ASN HBy 1.0 . 3.95 392 392 A 116 ASN H A 118 ASP H 1.0 . 5.27 393 393 A 146 ARG H A 85 GLN HA 1.0 . 5.07 394 394 A 158 GLU H A 156 CYS HBx 1.0 . 4.44 395 395 A 89 SER H A 114 GLN HA 1.0 . 4.96 396 396 A 155 GLY H A 70 VAL HA 1.0 . 4.40 397 397 A 6 GLY H A 7 LEU HDx% 1.0 . 5.08 398 398 A 6 GLY H A 7 LEU HDy% 1.0 . 5.08 399 399 A 32 GLY H A 31 PHE HBx 1.0 . 5.11 400 400 A 38 GLY H A 49 TRP HBx 1.0 . 5.50 401 401 A 14 ASP HA A 15 SER H 1.0 . 3.54 402 402 A 65 GLY H A 64 LEU HDx% 1.0 . 5.30 403 403 A 65 GLY H A 64 LEU HDy% 1.0 . 5.30 404 404 A 115 GLY H A 114 GLN HBy 1.0 . 3.93 405 405 A 9 ASN H A 8 LYS HBx 1.0 . 3.76 406 406 A 21 SER H A 52 GLN HBy 1.0 . 4.71 407 407 A 118 ASP H A 117 LEU HBx 1.0 . 4.56 408 408 A 94 HIS H A 102 THR HB 1.0 . 3.63 409 409 A 129 LYS H A 128 GLU HBx 1.0 . 5.06 410 410 A 129 LYS H A 128 GLU HBy 1.0 . 5.06 411 411 A 156 CYS H A 156 CYS HBy 1.0 . 3.78 412 412 A 156 CYS H A 71 THR H 1.0 . 4.30 413 413 A 156 CYS H A 155 GLY H 1.0 . 4.73 414 414 A 55 SER H A 54 ASN HD2x 1.0 . 5.50 415 415 A 57 LYS H A 143 TRP HZ3 1.0 . 5.50 416 416 A 146 ARG H A 147 ILE H 1.0 . 4.98 417 417 A 70 VAL H A 132 MET H 1.0 . 5.17 418 418 A 67 GLN H A 134 ARG H 1.0 . 5.50 419 419 A 133 ALA HB% A 134 ARG H 1.0 . 3.59 420 420 A 143 TRP H A 143 TRP HZ3 1.0 . 5.50 421 421 A 79 ARG H A 79 ARG HBy 1.0 . 3.87 422 422 A 37 LEU H A 49 TRP HBx 1.0 . 4.72 423 423 A 49 TRP HBy A 37 LEU H 1.0 . 4.97 424 424 A 37 LEU H A 37 LEU HDy% 1.0 . 3.92 425 425 A 42 ASN H A 40 LEU HA 1.0 . 4.53 426 426 A 92 VAL H A 92 VAL HGy% 1.0 . 4.00 427 427 A 101 TRP HBx A 102 THR H 1.0 . 3.98 428 428 A 7 LEU H A 5 LEU H 1.0 . 4.73 429 429 A 3 GLU H A 154 LEU HBx 1.0 . 4.19 430 430 A 8 LYS H A 8 LYS HBy 1.0 . 3.34 431 431 A 8 LYS H A 10 ASN HBy 1.0 . 4.60 432 432 A 123 LYS H A 75 THR HG2% 1.0 . 4.56 433 433 A 80 ASP H A 79 ARG HBx 1.0 . 4.03 434 434 A 37 LEU HA A 47 ASN H 1.0 . 5.49 435 435 A 148 THR HA A 149 LEU H 1.0 . 3.15 436 436 A 149 LEU H A 50 THR HA 1.0 . 4.43 437 437 A 149 LEU H A 148 THR HB 1.0 . 4.51 438 438 A 149 LEU H A 49 TRP HBx 1.0 . 5.50 439 439 A 149 LEU H A 50 THR HG2% 1.0 . 4.78 440 440 A 47 ASN H A 42 ASN HA 1.0 . 5.50 441 441 A 132 MET HA A 68 ARG H 1.0 . 4.57 442 442 A 68 ARG H A 134 ARG HA 1.0 . 4.84 443 443 A 73 ILE H A 125 ASN H 1.0 . 4.18 444 444 A 133 ALA H A 134 ARG H 1.0 . 4.69 445 445 A 50 THR H A 50 THR HG1 1.0 . 4.05 446 446 A 40 LEU H A 40 LEU HG 1.0 . 4.65 447 447 A 50 THR H A 148 THR HG2% 1.0 . 4.53 448 448 A 50 THR H A 46 ILE HG2% 1.0 . 4.91 449 449 A 68 ARG HA A 68 ARG HE 1.0 . 4.97 450 450 A 68 ARG HE A 68 ARG HGy 1.0 . 3.81 451 451 A 68 ARG HE A 68 ARG HGx 1.0 . 3.81 452 452 A 96 ASP H A 100 GLN H 1.0 . 5.25 453 453 A 153 LEU H A 152 GLU H 1.0 . 5.43 454 454 A 136 VAL HB A 137 ARG H 1.0 . 4.53 455 455 A 139 LEU H A 138 VAL HB 1.0 . 4.22 456 456 A 139 LEU H A 91 LYS HA 1.0 . 5.42 457 457 A 113 PHE H A 114 GLN H 1.0 . 4.60 458 458 A 100 GLN HA A 101 TRP HE1 1.0 . 5.50 459 459 A 101 TRP HA A 101 TRP HE1 1.0 . 5.50 460 460 A 99 VAL HB A 101 TRP HE1 1.0 . 5.13 461 461 A 99 VAL H A 101 TRP HE1 1.0 . 5.50 462 462 A 59 TRP H A 59 TRP HE1 1.0 . 4.92 463 463 A 154 LEU H A 73 ILE HA 1.0 . 4.13 464 464 A 153 LEU H A 154 LEU H 1.0 . 4.64 465 465 A 59 TRP HE1 A 20 SER HA 1.0 . 4.70 466 466 A 7 LEU H A 7 LEU HBy 1.0 . 3.74 467 467 A 7 LEU H A 8 LYS HBy 1.0 . 4.38 468 468 A 148 THR HG1 A 148 THR H 1.0 . 4.25 469 469 A 149 LEU H A 148 THR H 1.0 . 5.14 470 470 A 146 ARG H A 50 THR HG2% 1.0 . 5.50 471 471 A 117 LEU H A 117 LEU HBy 1.0 . 4.05 472 472 A 49 TRP HE1 A 51 ALA HA 1.0 . 5.03 473 473 A 51 ALA HA A 53 SER H 1.0 . 4.72 474 474 A 9 ASN H A 8 LYS HBy 1.0 . 3.60 475 475 A 7 LEU H A 12 ILE H 1.0 . 5.50 476 476 A 21 SER H A 22 SER H 1.0 . 4.49 477 477 A 22 SER H A 52 GLN HA 1.0 . 4.99 478 478 A 35 PRO HGy A 36 HIS H 1.0 . 4.00 479 479 A 51 ALA HB% A 55 SER H 1.0 . 4.36 480 480 A 58 GLU H A 55 SER H 1.0 . 4.43 481 481 A 64 LEU HG A 66 THR H 1.0 . 4.46 482 482 A 78 ALA H A 119 ASN HA 1.0 . 4.22 483 483 A 85 GLN H A 119 ASN HBx 1.0 . 5.50 484 484 A 85 GLN H A 119 ASN HBy 1.0 . 5.50 485 485 A 85 GLN H A 85 GLN HBx 1.0 . 4.03 486 486 A 85 GLN H A 84 ILE HB 1.0 . 4.39 487 487 A 86 TYR H A 85 GLN HGx 1.0 . 5.50 488 488 A 86 TYR H A 85 GLN HGy 1.0 . 5.50 489 489 A 148 THR HG1 A 86 TYR H 1.0 . 4.48 490 490 A 23 TYR H A 23 TYR HBx 1.0 . 3.82 491 491 A 23 TYR H A 23 TYR HBy 1.0 . 3.82 492 492 A 23 TYR H A 50 THR HB 1.0 . 4.34 493 493 A 91 LYS H A 112 VAL HGy% 1.0 . 5.06 494 494 A 94 HIS H A 136 VAL HA 1.0 . 4.94 495 495 A 101 TRP HE1 A 99 VAL HA 1.0 . 3.33 496 496 A 118 ASP H A 117 LEU HBy 1.0 . 4.56 497 497 A 131 PHE H A 130 PRO HDx 1.0 . 5.50 498 498 A 131 PHE H A 130 PRO HDy 1.0 . 5.50 499 499 A 150 ARG HA A 151 LEU H 1.0 . 3.33 500 500 A 9 ASN H A 10 ASN HBy 1.0 . 4.22 501 501 A 12 ILE H A 6 GLY HAx 1.0 . 4.48 502 502 A 12 ILE H A 11 THR HG2% 1.0 . 4.63 503 503 A 12 ILE H A 11 THR HG1 1.0 . 5.26 504 504 A 37 LEU H A 39 ARG H 1.0 . 4.00 505 505 A 38 GLY H A 39 ARG HBy 1.0 . 5.23 506 506 A 76 GLN H A 75 THR H 1.0 . 4.91 507 507 A 82 GLY H A 83 HIS H 1.0 . 4.27 508 508 A 22 SER HA A 23 TYR H 1.0 . 3.35 509 509 A 104 TYR H A 104 TYR HD% 1.0 . 4.07 510 510 A 105 GLU H A 104 TYR HD% 1.0 . 4.57 511 511 A 115 GLY H A 88 ALA HA 1.0 . 4.50 512 512 A 117 LEU HG A 118 ASP H 1.0 . 4.96 513 513 A 123 LYS H A 122 HIS HD1 1.0 . 4.85 514 514 A 123 LYS H A 122 HIS HD2 1.0 . 5.33 515 515 A 131 PHE H A 130 PRO HBy 1.0 . 4.37 516 516 A 133 ALA H A 67 GLN HA 1.0 . 4.12 517 517 A 139 LEU H A 138 VAL HA 1.0 . 3.18 518 518 A 142 SER H A 143 TRP HZ3 1.0 . 5.03 519 519 A 148 THR HG2% A 149 LEU H 1.0 . 3.49 520 520 A 157 LEU H A 155 GLY HAy 1.0 . 4.26 521 521 A 12 ILE H A 6 GLY HAy 1.0 . 4.48 522 522 A 19 ALA H A 20 SER H 1.0 . 4.46 523 523 A 49 TRP HE1 A 22 SER H 1.0 . 5.46 524 524 A 19 ALA HB% A 22 SER H 1.0 . 5.50 525 525 A 23 TYR H A 22 SER H 1.0 . 5.11 526 526 A 23 TYR H A 52 GLN H 1.0 . 5.46 527 527 A 23 TYR H A 50 THR HG2% 1.0 . 4.77 528 528 A 23 TYR H A 50 THR HG1 1.0 . 4.98 529 529 A 23 TYR H A 22 SER HBx 1.0 . 4.27 530 530 A 23 TYR H A 24 LYS H 1.0 . 4.82 531 531 A 23 TYR HA A 24 LYS H 1.0 . 3.43 532 532 A 24 LYS H A 23 TYR HBy 1.0 . 4.22 533 533 A 24 LYS H A 23 TYR HBx 1.0 . 4.22 534 534 A 51 ALA H A 146 ARG HDx 1.0 . 5.50 535 535 A 51 ALA H A 146 ARG HDy 1.0 . 5.50 536 536 A 52 GLN H A 53 SER H 1.0 . 3.47 537 537 A 53 SER H A 54 ASN H 1.0 . 4.32 538 538 A 58 GLU H A 56 ALA HA 1.0 . 4.37 539 539 A 137 ARG HA A 60 LEU H 1.0 . 5.50 540 540 A 135 TYR HA A 65 GLY H 1.0 . 5.19 541 541 A 71 THR H A 72 GLY HAy 1.0 . 4.96 542 542 A 85 GLN H A 148 THR HB 1.0 . 5.19 543 543 A 90 TYR H A 89 SER HA 1.0 . 3.49 544 544 A 73 ILE HG2% A 73 ILE H 1.0 . 3.53 545 545 A 94 HIS H A 95 SER H 1.0 . 4.68 546 546 A 134 ARG H A 95 SER H 1.0 . 5.26 547 547 A 101 TRP HBx A 101 TRP HE1 1.0 . 5.04 548 548 A 101 TRP HD1 A 102 THR H 1.0 . 4.61 549 549 A 113 PHE H A 92 VAL H 1.0 . 5.04 550 550 A 154 LEU H A 153 LEU HBy 1.0 . 4.12 551 551 A 155 GLY HAy A 70 VAL HA 1.0 . 4.23 552 552 A 17 MET HA A 62 VAL HA 1.0 . 4.02 553 553 A 62 VAL HA A 62 VAL HGx% 1.0 . 3.30 554 554 A 71 THR HG2% A 71 THR HA 1.0 . 3.49 555 555 A 59 TRP HA A 139 LEU HA 1.0 . 3.96 556 556 A 100 GLN HA A 100 GLN HBx 1.0 . 2.83 557 557 A 151 LEU HA A 75 THR HA 1.0 . 4.13 558 558 A 93 ALA HA A 103 VAL HA 1.0 . 3.59 559 559 A 153 LEU HA A 73 ILE HA 1.0 . 4.46 560 560 A 136 VAL HA A 94 HIS HBx 1.0 . 5.50 561 561 A 86 TYR HA A 77 GLY HAy 1.0 . 4.54 562 562 A 138 VAL HA A 92 VAL HA 1.0 . 4.47 563 563 A 76 GLN H A 75 THR HB 1.0 . 4.12 564 564 A 51 ALA H A 50 THR HB 1.0 . 4.23 565 565 A 154 LEU HBy A 71 THR HB 1.0 . 4.98 566 566 A 1 CYS HA A 156 CYS HA 1.0 . 3.20 567 567 A 154 LEU HBx A 2 SER HBx 1.0 . 4.73 568 568 A 154 LEU HBx A 2 SER HBy 1.0 . 4.73 569 569 A 154 LEU HBy A 2 SER HBx 1.0 . 5.50 570 570 A 154 LEU HBy A 2 SER HBy 1.0 . 5.50 571 571 A 60 LEU HA A 19 ALA HA 1.0 . 3.82 572 572 A 14 ASP HA A 36 HIS HBy 1.0 . 4.05 573 573 A 14 ASP HA A 36 HIS HBx 1.0 . 4.05 574 574 A 75 THR HA A 76 GLN HA 1.0 . 5.23 575 575 A 35 PRO HBx A 18 SER HA 1.0 . 4.21 576 576 A 18 SER HA A 35 PRO HBy 1.0 . 4.50 577 577 A 36 HIS HA A 36 HIS HD2 1.0 . 4.76 578 578 A 46 ILE HG2% A 47 ASN HA 1.0 . 5.27 579 579 A 42 ASN HA A 47 ASN HA 1.0 . 4.88 580 580 A 37 LEU HA A 47 ASN HA 1.0 . 5.13 581 581 A 86 TYR HA A 148 THR HB 1.0 . 4.38 582 582 A 22 SER HA A 51 ALA HA 1.0 . 3.64 583 583 A 19 ALA HB% A 60 LEU HA 1.0 . 2.81 584 584 A 19 ALA HA A 61 GLN HA 1.0 . 5.50 585 585 A 79 ARG HA A 84 ILE HA 1.0 . 3.62 586 586 A 84 ILE HA A 79 ARG HBy 1.0 . 4.70 587 587 A 95 SER H A 96 ASP HA 1.0 . 5.42 588 588 A 93 ALA HA A 102 THR HA 1.0 . 5.50 589 589 A 94 HIS H A 102 THR HA 1.0 . 4.80 590 590 A 93 ALA HA A 102 THR HB 1.0 . 4.99 591 591 A 74 ILE HD1% A 122 HIS HBx 1.0 . 4.19 592 592 A 155 GLY HAy A 70 VAL HB 1.0 . 4.57 593 593 A 71 THR HG2% A 155 GLY HAy 1.0 . 5.03 594 594 A 155 GLY HAy A 70 VAL HGx% 1.0 . 4.24 595 595 A 154 LEU HA A 155 GLY HAy 1.0 . 5.50 596 596 A 154 LEU HA A 2 SER HA 1.0 . 4.85 597 597 A 154 LEU HA A 154 LEU HDy% 1.0 . 4.08 598 598 A 151 LEU HA A 150 ARG H 1.0 . 4.79 599 599 A 148 THR HB A 85 GLN HGx 1.0 . 5.50 600 600 A 148 THR HB A 85 GLN HGy 1.0 . 5.50 601 601 A 146 ARG HA A 146 ARG HGx 1.0 . 3.98 602 602 A 143 TRP HA A 87 VAL HGx% 1.0 . 4.28 603 603 A 88 ALA HB% A 143 TRP HA 1.0 . 4.42 604 604 A 141 VAL HA A 142 SER HA 1.0 . 4.77 605 605 A 138 VAL HA A 138 VAL HGy% 1.0 . 3.81 606 606 A 137 ARG HA A 61 GLN HA 1.0 . 4.68 607 607 A 63 ASP HA A 135 TYR HA 1.0 . 4.56 608 608 A 69 GLN HA A 132 MET HA 1.0 . 4.00 609 609 A 132 MET HA A 133 ALA HA 1.0 . 5.19 610 610 A 133 ALA HB% A 132 MET HA 1.0 . 4.50 611 611 A 70 VAL HGx% A 132 MET HA 1.0 . 4.63 612 612 A 127 PHE HA A 128 GLU HBx 1.0 . 5.50 613 613 A 127 PHE HA A 128 GLU HBy 1.0 . 5.50 614 614 A 73 ILE H A 126 ILE HA 1.0 . 5.46 615 615 A 126 ILE HA A 72 GLY HAy 1.0 . 4.92 616 616 A 126 ILE HD1% A 126 ILE HA 1.0 . 3.82 617 617 A 136 VAL HA A 94 HIS HA 1.0 . 4.40 618 618 A 136 VAL HGy% A 94 HIS HA 1.0 . 4.81 619 619 A 136 VAL HGx% A 94 HIS HA 1.0 . 4.98 620 620 A 101 TRP HA A 94 HIS HA 1.0 . 5.34 621 621 A 137 ARG HA A 136 VAL HGy% 1.0 . 4.49 622 622 A 136 VAL HGy% A 61 GLN HA 1.0 . 5.08 623 623 A 140 PRO HA A 90 TYR HBx 1.0 . 5.25 624 624 A 140 PRO HA A 90 TYR HBy 1.0 . 5.25 625 625 A 140 PRO HA A 141 VAL HA 1.0 . 5.33 626 626 A 127 PHE H A 71 THR HA 1.0 . 5.37 627 627 A 71 THR HA A 127 PHE HBx 1.0 . 4.99 628 628 A 130 PRO HBy A 71 THR HA 1.0 . 4.31 629 629 A 75 THR HA A 74 ILE HA 1.0 . 5.38 630 630 A 150 ARG H A 76 GLN HA 1.0 . 5.43 631 631 A 148 THR HA A 50 THR HA 1.0 . 3.32 632 632 A 51 ALA H A 148 THR HA 1.0 . 5.50 633 633 A 148 THR HA A 147 ILE H 1.0 . 5.50 634 634 A 75 THR HA A 74 ILE H 1.0 . 5.50 635 635 A 150 ARG H A 75 THR HA 1.0 . 5.50 636 636 A 7 LEU HA A 8 LYS HA 1.0 . 4.63 637 637 A 14 ASP HA A 13 PRO HA 1.0 . 4.39 638 638 A 37 LEU H A 35 PRO HA 1.0 . 4.16 639 639 A 49 TRP HBy A 35 PRO HA 1.0 . 4.10 640 640 A 49 TRP HBx A 35 PRO HA 1.0 . 4.60 641 641 A 35 PRO HA A 49 TRP HA 1.0 . 4.31 642 642 A 36 HIS HA A 17 MET HGx 1.0 . 5.45 643 643 A 36 HIS HA A 17 MET HGy 1.0 . 5.45 644 644 A 56 ALA HB% A 141 VAL HA 1.0 . 3.39 645 645 A 135 TYR HA A 136 VAL HGx% 1.0 . 4.89 646 646 A 133 ALA HB% A 136 VAL HA 1.0 . 4.99 647 647 A 135 TYR HA A 136 VAL HA 1.0 . 5.50 648 648 A 148 THR HG2% A 78 ALA HB% 1.0 . 2.62 649 649 A 48 ALA HA A 38 GLY HAy 1.0 . 4.48 650 650 A 79 ARG HA A 79 ARG HGy 1.0 . 4.23 651 651 A 84 ILE HB A 84 ILE HD1% 1.0 . 4.07 652 652 A 84 ILE HA A 79 ARG HGy 1.0 . 5.50 653 653 A 84 ILE HG2% A 84 ILE HA 1.0 . 3.64 654 654 A 84 ILE HA A 84 ILE HD1% 1.0 . 4.16 655 655 A 85 GLN HA A 148 THR HB 1.0 . 5.50 656 656 A 86 TYR HA A 77 GLY HAx 1.0 . 4.54 657 657 A 86 TYR HA A 148 THR HG2% 1.0 . 5.50 658 658 A 86 TYR HA A 148 THR HG1 1.0 . 5.50 659 659 A 86 TYR HA A 87 VAL HA 1.0 . 4.54 660 660 A 87 VAL HA A 88 ALA HA 1.0 . 5.50 661 661 A 130 PRO HA A 131 PHE HA 1.0 . 5.50 662 662 A 154 LEU HA A 4 PRO HA 1.0 . 4.83 663 663 A 90 TYR HA A 140 PRO HA 1.0 . 4.52 664 664 A 90 TYR HA A 139 LEU HA 1.0 . 5.50 665 665 A 91 LYS HA A 112 VAL HA 1.0 . 4.74 666 666 A 139 LEU H A 92 VAL HA 1.0 . 4.73 667 667 A 87 VAL HA A 147 ILE HA 1.0 . 4.84 668 668 A 146 ARG HA A 147 ILE HA 1.0 . 5.21 669 669 A 143 TRP HA A 147 ILE HA 1.0 . 5.50 670 670 A 146 ARG HA A 50 THR HG2% 1.0 . 4.81 671 671 A 141 VAL HA A 141 VAL HGx% 1.0 . 3.32 672 672 A 90 TYR HA A 141 VAL HA 1.0 . 5.50 673 673 A 136 VAL HB A 137 ARG HA 1.0 . 5.50 674 674 A 135 TYR HA A 62 VAL HB 1.0 . 5.50 675 675 A 135 TYR H A 133 ALA HA 1.0 . 4.42 676 676 A 70 VAL HGy% A 132 MET HA 1.0 . 4.98 677 677 A 75 THR H A 124 LYS HA 1.0 . 5.44 678 678 A 119 ASN HA A 77 GLY HAy 1.0 . 4.69 679 679 A 105 GLU HA A 110 SER HA 1.0 . 3.26 680 680 A 46 ILE HG2% A 46 ILE HA 1.0 . 3.17 681 681 A 46 ILE HG2% A 46 ILE HD1% 1.0 . 3.19 682 682 A 37 LEU HA A 37 LEU HDx% 1.0 . 4.09 683 683 A 46 ILE HA A 46 ILE HG1x 1.0 . 3.97 684 684 A 46 ILE HA A 46 ILE HG1y 1.0 . 3.97 685 685 A 46 ILE HD1% A 46 ILE HB 1.0 . 2.99 686 686 A 46 ILE HA A 46 ILE HD1% 1.0 . 3.85 687 687 A 62 VAL HA A 62 VAL HGy% 1.0 . 3.30 688 688 A 46 ILE HG2% A 37 LEU HBx 1.0 . 4.93 689 689 A 46 ILE HG2% A 37 LEU HBy 1.0 . 4.93 690 690 A 70 VAL HGy% A 70 VAL HA 1.0 . 3.99 691 691 A 70 VAL HGy% A 130 PRO HA 1.0 . 4.13 692 692 A 70 VAL HGx% A 70 VAL HA 1.0 . 3.54 693 693 A 87 VAL HA A 87 VAL HGx% 1.0 . 3.46 694 694 A 87 VAL HA A 87 VAL HGy% 1.0 . 3.46 695 695 A 92 VAL HA A 92 VAL HGy% 1.0 . 3.48 696 696 A 92 VAL HA A 92 VAL HGx% 1.0 . 3.48 697 697 A 99 VAL HA A 99 VAL HGx% 1.0 . 3.21 698 698 A 99 VAL HA A 99 VAL HGy% 1.0 . 3.21 699 699 A 103 VAL HA A 103 VAL HGx% 1.0 . 3.27 700 700 A 103 VAL HA A 103 VAL HGy% 1.0 . 3.27 701 701 A 101 TRP HD1 A 99 VAL HA 1.0 . 4.61 702 702 A 137 ARG H A 92 VAL HA 1.0 . 5.50 703 703 A 104 TYR HD% A 92 VAL HGy% 1.0 . 4.37 704 704 A 104 TYR HD% A 92 VAL HGx% 1.0 . 4.37 705 705 A 87 VAL HA A 143 TRP HBx 1.0 . 4.99 706 706 A 147 ILE HG2% A 87 VAL HGy% 1.0 . 4.01 707 707 A 143 TRP HA A 87 VAL HGy% 1.0 . 4.28 708 708 A 71 THR H A 70 VAL HGy% 1.0 . 3.87 709 709 A 69 GLN HA A 70 VAL HGx% 1.0 . 3.83 710 710 A 49 TRP HBy A 46 ILE HG2% 1.0 . 5.48 711 711 A 46 ILE HD1% A 45 LYS HA 1.0 . 4.87 712 712 A 112 VAL HA A 112 VAL HGx% 1.0 . 3.33 713 713 A 112 VAL HA A 112 VAL HGy% 1.0 . 3.33 714 714 A 112 VAL HA A 91 LYS HDx 1.0 . 5.50 715 715 A 112 VAL HA A 91 LYS HDy 1.0 . 5.50 716 716 A 112 VAL H A 112 VAL HGy% 1.0 . 4.13 717 717 A 91 LYS H A 112 VAL HGx% 1.0 . 5.06 718 718 A 113 PHE H A 112 VAL HGx% 1.0 . 4.87 719 719 A 136 VAL HGy% A 136 VAL HA 1.0 . 3.62 720 720 A 136 VAL HGx% A 136 VAL HA 1.0 . 3.79 721 721 A 94 HIS HD2 A 136 VAL HA 1.0 . 5.25 722 722 A 93 ALA H A 136 VAL HA 1.0 . 5.50 723 723 A 136 VAL HB A 135 TYR HA 1.0 . 5.50 724 724 A 136 VAL HGy% A 137 ARG H 1.0 . 3.39 725 725 A 138 VAL HA A 138 VAL HGx% 1.0 . 3.81 726 726 A 139 LEU H A 138 VAL HGx% 1.0 . 4.04 727 727 A 90 TYR HA A 141 VAL HGy% 1.0 . 3.79 728 728 A 141 VAL HA A 141 VAL HGy% 1.0 . 3.32 729 729 A 143 TRP HZ3 A 141 VAL HA 1.0 . 4.01 730 730 A 56 ALA HB% A 141 VAL HGy% 1.0 . 4.14 731 731 A 141 VAL H A 141 VAL HGy% 1.0 . 4.21 732 732 A 147 ILE HD1% A 147 ILE HA 1.0 . 3.90 733 733 A 147 ILE HA A 147 ILE HG2% 1.0 . 3.46 734 734 A 147 ILE HD1% A 147 ILE HB 1.0 . 3.23 735 735 A 147 ILE HD1% A 147 ILE HG2% 1.0 . 3.24 736 736 A 86 TYR HA A 147 ILE HA 1.0 . 5.35 737 737 A 148 THR HA A 147 ILE HA 1.0 . 5.50 738 738 A 143 TRP HD1 A 147 ILE HA 1.0 . 5.50 739 739 A 54 ASN HA A 147 ILE HB 1.0 . 5.24 740 740 A 147 ILE HB A 146 ARG HDx 1.0 . 5.50 741 741 A 147 ILE HB A 146 ARG HDy 1.0 . 5.50 742 742 A 148 THR HA A 147 ILE HG2% 1.0 . 4.12 743 743 A 147 ILE H A 147 ILE HG2% 1.0 . 3.79 744 744 A 147 ILE HG2% A 87 VAL HGx% 1.0 . 4.01 745 745 A 147 ILE HD1% A 146 ARG HDx 1.0 . 4.15 746 746 A 147 ILE HD1% A 146 ARG HDy 1.0 . 4.15 747 747 A 147 ILE HD1% A 54 ASN HA 1.0 . 3.34 748 748 A 147 ILE HD1% A 146 ARG HA 1.0 . 4.03 749 749 A 147 ILE HD1% A 55 SER HA 1.0 . 4.39 750 750 A 147 ILE HD1% A 143 TRP HA 1.0 . 5.50 751 751 A 147 ILE HD1% A 143 TRP HD1 1.0 . 4.04 752 752 A 126 ILE HB A 126 ILE HD1% 1.0 . 3.35 753 753 A 126 ILE HG2% A 126 ILE HA 1.0 . 3.30 754 754 A 73 ILE HD1% A 74 ILE HA 1.0 . 4.24 755 755 A 74 ILE HD1% A 74 ILE HA 1.0 . 4.37 756 756 A 74 ILE HD1% A 74 ILE HB 1.0 . 3.82 757 757 A 157 LEU HA A 157 LEU HDy% 1.0 . 3.41 758 758 A 157 LEU HA A 157 LEU HG 1.0 . 3.78 759 759 A 157 LEU HA A 157 LEU HDx% 1.0 . 3.41 760 760 A 154 LEU HA A 154 LEU HDx% 1.0 . 4.08 761 761 A 117 LEU HG A 117 LEU HA 1.0 . 4.06 762 762 A 11 THR HG2% A 11 THR HA 1.0 . 3.47 763 763 A 11 THR HG1 A 11 THR HA 1.0 . 3.97 764 764 A 50 THR HA A 50 THR HG2% 1.0 . 3.30 765 765 A 50 THR HB A 23 TYR HBx 1.0 . 4.76 766 766 A 50 THR HB A 23 TYR HBy 1.0 . 4.76 767 767 A 148 THR HG2% A 50 THR HG2% 1.0 . 3.63 768 768 A 50 THR HG2% A 23 TYR HBx 1.0 . 4.24 769 769 A 50 THR HG2% A 23 TYR HBy 1.0 . 4.24 770 770 A 148 THR HB A 50 THR HG2% 1.0 . 4.14 771 771 A 148 THR HA A 50 THR HG2% 1.0 . 3.72 772 772 A 22 SER HA A 50 THR HB 1.0 . 5.50 773 773 A 66 THR HG2% A 68 ARG HGx 1.0 . 4.24 774 774 A 66 THR HG2% A 66 THR HA 1.0 . 3.69 775 775 A 66 THR HA A 66 THR HG1 1.0 . 3.82 776 776 A 64 LEU HG A 66 THR HB 1.0 . 5.50 777 777 A 66 THR HG2% A 68 ARG HDx 1.0 . 4.66 778 778 A 66 THR HG2% A 68 ARG HA 1.0 . 4.46 779 779 A 66 THR HG2% A 68 ARG H 1.0 . 4.18 780 780 A 66 THR HG2% A 68 ARG HGy 1.0 . 4.24 781 781 A 71 THR HA A 127 PHE HBy 1.0 . 4.99 782 782 A 127 PHE HD% A 71 THR HA 1.0 . 5.18 783 783 A 71 THR HB A 130 PRO HBy 1.0 . 5.50 784 784 A 1 CYS HBx A 71 THR HB 1.0 . 5.50 785 785 A 1 CYS HBy A 71 THR HB 1.0 . 5.50 786 786 A 71 THR HG2% A 130 PRO HBy 1.0 . 3.43 787 787 A 71 THR HG2% A 71 THR H 1.0 . 4.01 788 788 A 75 THR HA A 75 THR HG2% 1.0 . 3.41 789 789 A 151 LEU HA A 75 THR HB 1.0 . 5.23 790 790 A 76 GLN H A 75 THR HG2% 1.0 . 4.07 791 791 A 102 THR HG2% A 102 THR HA 1.0 . 2.72 792 792 A 93 ALA HB% A 102 THR HA 1.0 . 5.27 793 793 A 93 ALA HB% A 102 THR HB 1.0 . 5.25 794 794 A 101 TRP HA A 102 THR HB 1.0 . 5.01 795 795 A 93 ALA HA A 102 THR HG2% 1.0 . 4.56 796 796 A 102 THR HG2% A 103 VAL H 1.0 . 3.78 797 797 A 94 HIS H A 102 THR HG2% 1.0 . 3.87 798 798 A 148 THR HG2% A 148 THR HA 1.0 . 2.99 799 799 A 148 THR HA A 50 THR HB 1.0 . 5.45 800 800 A 148 THR HB A 85 GLN HBx 1.0 . 4.25 801 801 A 148 THR HB A 85 GLN HBy 1.0 . 4.25 802 802 A 148 THR HB A 50 THR HA 1.0 . 5.49 803 803 A 148 THR HG2% A 50 THR HA 1.0 . 3.43 804 804 A 19 ALA HB% A 35 PRO HBy 1.0 . 4.16 805 805 A 32 GLY H A 30 ALA HB% 1.0 . 4.29 806 806 A 30 ALA HB% A 31 PHE HA 1.0 . 4.48 807 807 A 148 THR HG2% A 48 ALA HB% 1.0 . 2.90 808 808 A 148 THR HG2% A 48 ALA HA 1.0 . 5.42 809 809 A 48 ALA HA A 38 GLY HAx 1.0 . 4.48 810 810 A 51 ALA HB% A 147 ILE HD1% 1.0 . 3.16 811 811 A 51 ALA HB% A 147 ILE HG2% 1.0 . 3.19 812 812 A 56 ALA HB% A 141 VAL HGx% 1.0 . 4.14 813 813 A 56 ALA HB% A 143 TRP HZ3 1.0 . 3.74 814 814 A 148 THR HG2% A 78 ALA HA 1.0 . 4.90 815 815 A 78 ALA HB% A 48 ALA HB% 1.0 . 2.87 816 816 A 78 ALA HB% A 148 THR HA 1.0 . 4.68 817 817 A 93 ALA HA A 136 VAL HB 1.0 . 5.50 818 818 A 93 ALA HA A 101 TRP HBx 1.0 . 5.32 819 819 A 93 ALA HB% A 103 VAL HB 1.0 . 4.95 820 820 A 136 VAL HB A 93 ALA HB% 1.0 . 5.50 821 821 A 93 ALA HB% A 101 TRP HBx 1.0 . 3.39 822 822 A 103 VAL HA A 93 ALA HB% 1.0 . 3.24 823 823 A 93 ALA H A 93 ALA HB% 1.0 . 3.07 824 824 A 137 ARG H A 93 ALA HB% 1.0 . 4.11 825 825 A 94 HIS HD2 A 93 ALA HB% 1.0 . 4.34 826 826 A 136 VAL HGx% A 133 ALA HA 1.0 . 5.50 827 827 A 127 PHE HD% A 129 LYS HA 1.0 . 5.50 828 828 A 133 ALA HB% A 70 VAL HGx% 1.0 . 3.65 829 829 A 133 ALA HB% A 136 VAL HGx% 1.0 . 3.31 830 830 A 133 ALA HB% A 94 HIS HBx 1.0 . 4.11 831 831 A 133 ALA HB% A 94 HIS HBy 1.0 . 4.11 832 832 A 133 ALA HB% A 96 ASP HA 1.0 . 4.48 833 833 A 133 ALA HB% A 94 HIS HA 1.0 . 4.26 834 834 A 37 LEU H A 49 TRP HA 1.0 . 4.97 835 835 A 59 TRP HA A 60 LEU HBy 1.0 . 4.96 836 836 A 59 TRP HA A 139 LEU HDx% 1.0 . 5.50 837 837 A 59 TRP HA A 139 LEU HDy% 1.0 . 5.50 838 838 A 59 TRP HA A 139 LEU HBx 1.0 . 5.50 839 839 A 59 TRP HA A 139 LEU HBy 1.0 . 5.50 840 840 A 60 LEU HBx A 59 TRP HBy 1.0 . 5.50 841 841 A 93 ALA HB% A 101 TRP HBy 1.0 . 4.53 842 842 A 87 VAL HA A 143 TRP HA 1.0 . 3.68 843 843 A 87 VAL HA A 143 TRP HBy 1.0 . 4.99 844 844 A 81 PHE HA A 81 PHE HD% 1.0 . 3.87 845 845 A 113 PHE HA A 113 PHE HD% 1.0 . 3.87 846 846 A 127 PHE HD% A 127 PHE HA 1.0 . 3.81 847 847 A 154 LEU HBy A 153 LEU HA 1.0 . 4.87 848 848 A 69 GLN HBx A 131 PHE HA 1.0 . 4.82 849 849 A 68 ARG HA A 68 ARG HDy 1.0 . 3.66 850 850 A 68 ARG HA A 68 ARG HDx 1.0 . 3.66 851 851 A 79 ARG HA A 79 ARG HDy 1.0 . 5.50 852 852 A 79 ARG HA A 79 ARG HGx 1.0 . 4.23 853 853 A 84 ILE HA A 79 ARG HBx 1.0 . 4.70 854 854 A 84 ILE HA A 79 ARG HGx 1.0 . 5.50 855 855 A 84 ILE HA A 79 ARG HDx 1.0 . 5.50 856 856 A 84 ILE HA A 79 ARG HDy 1.0 . 5.50 857 857 A 36 HIS HA A 37 LEU HDy% 1.0 . 5.34 858 858 A 36 HIS HA A 37 LEU HDx% 1.0 . 5.34 859 859 A 35 PRO HGy A 36 HIS HA 1.0 . 5.50 860 860 A 35 PRO HBx A 36 HIS HA 1.0 . 4.74 861 861 A 14 ASP HA A 36 HIS HA 1.0 . 5.29 862 862 A 14 ASP HBx A 36 HIS HBx 1.0 . 5.50 863 863 A 94 HIS HD2 A 94 HIS HA 1.0 . 4.53 864 864 A 94 HIS HA A 94 HIS HE1 1.0 . 5.50 865 865 A 136 VAL HGx% A 94 HIS HBy 1.0 . 5.31 866 866 A 136 VAL HGx% A 94 HIS HBx 1.0 . 5.31 867 867 A 136 VAL HA A 94 HIS HBy 1.0 . 5.50 868 868 A 74 ILE HD1% A 122 HIS HA 1.0 . 4.03 869 869 A 122 HIS HA A 122 HIS HD1 1.0 . 4.70 870 870 A 122 HIS HA A 122 HIS HD2 1.0 . 5.25 871 871 A 74 ILE HD1% A 122 HIS HBy 1.0 . 4.19 872 872 A 39 ARG HA A 7 LEU HDx% 1.0 . 5.50 873 873 A 39 ARG HA A 7 LEU HDy% 1.0 . 5.50 874 874 A 93 ALA HA A 103 VAL HB 1.0 . 5.50 875 875 A 134 ARG HA A 67 GLN HA 1.0 . 3.93 876 876 A 67 GLN HA A 67 GLN HGy 1.0 . 3.94 877 877 A 67 GLN HA A 67 GLN HGx 1.0 . 3.94 878 878 A 133 ALA H A 67 GLN HGy 1.0 . 5.22 879 879 A 68 ARG H A 67 GLN HGx 1.0 . 4.89 880 880 A 133 ALA H A 67 GLN HGx 1.0 . 5.22 881 881 A 100 GLN HBy A 100 GLN HGx 1.0 . 2.67 882 882 A 100 GLN HBx A 100 GLN HGy 1.0 . 2.69 883 883 A 100 GLN HA A 100 GLN HGx 1.0 . 3.46 884 884 A 100 GLN HA A 100 GLN HGy 1.0 . 3.24 885 885 A 101 TRP HD1 A 100 GLN HA 1.0 . 5.07 886 886 A 99 VAL HB A 100 GLN HGx 1.0 . 5.22 887 887 A 100 GLN HGx A 99 VAL HGx% 1.0 . 4.85 888 888 A 100 GLN HGx A 99 VAL HGy% 1.0 . 4.85 889 889 A 114 GLN HA A 114 GLN HGx 1.0 . 4.25 890 890 A 114 GLN HA A 114 GLN HGy 1.0 . 4.25 891 891 A 90 TYR H A 114 GLN HA 1.0 . 4.36 892 892 A 43 GLN HGy A 44 GLY HAx 1.0 . 5.50 893 893 A 110 SER HA A 105 GLU HBy 1.0 . 3.87 894 894 A 110 SER HA A 105 GLU HBx 1.0 . 3.87 895 895 A 105 GLU HA A 105 GLU HGx 1.0 . 3.95 896 896 A 105 GLU HA A 105 GLU HGy 1.0 . 3.95 897 897 A 105 GLU HA A 104 TYR HBx 1.0 . 5.50 898 898 A 105 GLU HA A 104 TYR HBy 1.0 . 5.50 899 899 A 105 GLU HA A 110 SER HBx 1.0 . 5.36 900 900 A 105 GLU HA A 110 SER HBy 1.0 . 5.36 901 901 A 106 GLU HA A 106 GLU HGx 1.0 . 4.21 902 902 A 106 GLU HA A 106 GLU HGy 1.0 . 4.21 903 903 A 128 GLU HA A 128 GLU HGy 1.0 . 3.83 904 904 A 128 GLU HA A 128 GLU HGx 1.0 . 3.83 905 905 A 158 GLU HA A 158 GLU HGx 1.0 . 4.15 906 906 A 158 GLU HA A 158 GLU HGy 1.0 . 4.15 907 907 A 9 ASN HA A 8 LYS HBx 1.0 . 4.76 908 908 A 11 THR HG2% A 10 ASN HBy 1.0 . 5.24 909 909 A 11 THR HG2% A 10 ASN HBx 1.0 . 5.50 910 910 A 6 GLY H A 10 ASN HBy 1.0 . 4.77 911 911 A 39 ARG HGx A 42 ASN HBy 1.0 . 5.50 912 912 A 42 ASN HBy A 39 ARG HGy 1.0 . 5.50 913 913 A 39 ARG HGx A 42 ASN HBx 1.0 . 5.50 914 914 A 39 ARG HGy A 42 ASN HBx 1.0 . 5.50 915 915 A 54 ASN HA A 147 ILE HG2% 1.0 . 4.73 916 916 A 51 ALA HB% A 54 ASN HA 1.0 . 4.55 917 917 A 54 ASN HA A 146 ARG HDx 1.0 . 5.50 918 918 A 54 ASN HA A 146 ARG HDy 1.0 . 5.50 919 919 A 55 SER HA A 54 ASN HA 1.0 . 5.34 920 920 A 131 PHE HA A 130 PRO HGx 1.0 . 5.44 921 921 A 14 ASP HBy A 36 HIS HBx 1.0 . 5.50 922 922 A 36 HIS HBy A 14 ASP HBy 1.0 . 5.50 923 923 A 36 HIS HBy A 14 ASP HBx 1.0 . 5.50 924 924 A 80 ASP HA A 81 PHE HD% 1.0 . 4.10 925 925 A 81 PHE HD% A 80 ASP HBy 1.0 . 5.03 926 926 A 81 PHE HD% A 80 ASP HBx 1.0 . 5.03 927 927 A 11 THR HG2% A 6 GLY HAy 1.0 . 5.14 928 928 A 6 GLY HAy A 12 ILE HG1x 1.0 . 5.50 929 929 A 6 GLY HAy A 12 ILE HG1y 1.0 . 5.50 930 930 A 11 THR HG2% A 6 GLY HAx 1.0 . 5.14 931 931 A 12 ILE HG1x A 6 GLY HAx 1.0 . 5.50 932 932 A 6 GLY HAx A 12 ILE HG1y 1.0 . 5.50 933 933 A 119 ASN HA A 77 GLY HAx 1.0 . 4.69 934 934 A 44 GLY HAy A 43 GLN HGx 1.0 . 5.50 935 935 A 43 GLN HGy A 44 GLY HAy 1.0 . 5.50 936 936 A 43 GLN HBy A 44 GLY HAy 1.0 . 5.26 937 937 A 44 GLY HAy A 45 LYS HGy 1.0 . 5.50 938 938 A 44 GLY HAy A 45 LYS HGx 1.0 . 5.50 939 939 A 43 GLN HGx A 44 GLY HAx 1.0 . 5.50 940 940 A 44 GLY HAx A 45 LYS HGy 1.0 . 5.50 941 941 A 45 LYS HGx A 44 GLY HAx 1.0 . 5.50 942 942 A 43 GLN HBy A 44 GLY HAx 1.0 . 5.26 943 943 A 70 VAL HB A 72 GLY HAy 1.0 . 5.50 944 944 A 70 VAL HB A 72 GLY HAx 1.0 . 5.50 945 945 A 71 THR HG2% A 72 GLY HAx 1.0 . 5.50 946 946 A 126 ILE HA A 72 GLY HAx 1.0 . 4.92 947 947 A 71 THR HG2% A 72 GLY HAy 1.0 . 5.50 948 948 A 98 GLY HAy A 95 SER H 1.0 . 5.50 949 949 A 70 VAL HB A 155 GLY HAx 1.0 . 5.50 950 950 A 154 LEU HBx A 155 GLY HAx 1.0 . 5.50 951 951 A 155 GLY HAy A 154 LEU HBx 1.0 . 5.50 952 952 A 154 LEU HBy A 155 GLY HAy 1.0 . 5.05 953 953 A 70 VAL HGx% A 155 GLY HAx 1.0 . 4.62 954 954 A 71 THR H A 155 GLY HAx 1.0 . 4.60 955 955 A 70 VAL H A 155 GLY HAx 1.0 . 5.34 956 956 A 72 GLY H A 155 GLY HAx 1.0 . 5.50 957 957 A 132 MET HA A 69 GLN HBx 1.0 . 3.68 958 958 A 46 ILE H A 45 LYS HA 1.0 . 3.53 959 959 A 46 ILE H A 45 LYS H 1.0 . 3.60 960 960 A 46 ILE H A 47 ASN H 1.0 . 3.57 961 961 A 46 ILE H A 46 ILE HG2% 1.0 . 3.94 962 962 A 46 ILE H A 46 ILE HB 1.0 . 3.02 963 963 A 46 ILE H A 46 ILE HG1x 1.0 . 3.84 964 964 A 46 ILE H A 46 ILE HD1% 1.0 . 3.73 965 965 A 12 ILE H A 11 THR H 1.0 . 3.28 966 966 A 62 VAL H A 61 GLN HA 1.0 . 3.35 967 967 A 61 GLN H A 62 VAL H 1.0 . 4.93 968 968 A 62 VAL H A 62 VAL HB 1.0 . 3.35 969 969 A 69 GLN H A 70 VAL H 1.0 . 4.72 970 970 A 69 GLN HA A 70 VAL H 1.0 . 3.23 971 971 A 70 VAL HGx% A 70 VAL H 1.0 . 3.21 972 972 A 70 VAL HGy% A 70 VAL H 1.0 . 3.20 973 973 A 87 VAL H A 87 VAL HGx% 1.0 . 4.17 974 974 A 87 VAL H A 87 VAL HB 1.0 . 3.83 975 975 A 87 VAL H A 87 VAL HGy% 1.0 . 4.17 976 976 A 92 VAL H A 92 VAL HB 1.0 . 3.78 977 977 A 99 VAL H A 98 GLY H 1.0 . 3.78 978 978 A 99 VAL H A 99 VAL HB 1.0 . 3.84 979 979 A 99 VAL H A 99 VAL HGy% 1.0 . 3.82 980 980 A 99 VAL H A 99 VAL HGx% 1.0 . 3.82 981 981 A 102 THR HA A 103 VAL H 1.0 . 2.63 982 982 A 103 VAL H A 103 VAL HGx% 1.0 . 3.99 983 983 A 103 VAL H A 103 VAL HGy% 1.0 . 3.99 984 984 A 103 VAL HB A 103 VAL H 1.0 . 3.64 985 985 A 102 THR HB A 103 VAL H 1.0 . 4.52 986 986 A 93 ALA HA A 103 VAL H 1.0 . 4.74 987 987 A 104 TYR H A 103 VAL H 1.0 . 4.60 988 988 A 99 VAL H A 100 GLN HBy 1.0 . 4.59 989 989 A 99 VAL H A 100 GLN HA 1.0 . 5.07 990 990 A 104 TYR HD% A 92 VAL H 1.0 . 5.50 991 991 A 92 VAL H A 113 PHE HD% 1.0 . 5.50 992 992 A 87 VAL H A 86 TYR HBy 1.0 . 4.51 993 993 A 70 VAL H A 69 GLN HBx 1.0 . 4.58 994 994 A 69 GLN HBy A 70 VAL H 1.0 . 5.00 995 995 A 132 MET HA A 70 VAL H 1.0 . 3.85 996 996 A 46 ILE H A 47 ASN HA 1.0 . 5.34 997 997 A 112 VAL H A 111 LYS HA 1.0 . 2.87 998 998 A 112 VAL H A 112 VAL HGx% 1.0 . 4.13 999 999 A 112 VAL H A 111 LYS HDx 1.0 . 4.23 1000 1000 A 113 PHE H A 112 VAL H 1.0 . 4.70 1001 1001 A 112 VAL H A 113 PHE HD% 1.0 . 5.50 1002 1002 A 112 VAL H A 111 LYS HDy 1.0 . 4.23 1003 1003 A 135 TYR HA A 136 VAL H 1.0 . 3.13 1004 1004 A 135 TYR H A 136 VAL H 1.0 . 4.41 1005 1005 A 136 VAL H A 62 VAL HB 1.0 . 4.28 1006 1006 A 136 VAL HGy% A 136 VAL H 1.0 . 3.60 1007 1007 A 136 VAL HGx% A 136 VAL H 1.0 . 3.82 1008 1008 A 136 VAL H A 135 TYR HBy 1.0 . 4.51 1009 1009 A 62 VAL H A 136 VAL H 1.0 . 3.97 1010 1010 A 137 ARG HA A 138 VAL H 1.0 . 3.19 1011 1011 A 137 ARG H A 138 VAL H 1.0 . 4.41 1012 1012 A 138 VAL H A 138 VAL HB 1.0 . 3.98 1013 1013 A 59 TRP HA A 138 VAL H 1.0 . 5.50 1014 1014 A 138 VAL H A 92 VAL HA 1.0 . 5.50 1015 1015 A 60 LEU H A 138 VAL H 1.0 . 3.76 1016 1016 A 141 VAL H A 90 TYR HA 1.0 . 3.82 1017 1017 A 141 VAL H A 141 VAL HGx% 1.0 . 4.21 1018 1018 A 141 VAL H A 56 ALA HB% 1.0 . 5.10 1019 1019 A 146 ARG HA A 147 ILE H 1.0 . 3.47 1020 1020 A 147 ILE H A 147 ILE HB 1.0 . 3.52 1021 1021 A 147 ILE HD1% A 147 ILE H 1.0 . 3.57 1022 1022 A 147 ILE H A 146 ARG HDx 1.0 . 5.34 1023 1023 A 147 ILE H A 146 ARG HDy 1.0 . 5.34 1024 1024 A 126 ILE H A 125 ASN HA 1.0 . 2.73 1025 1025 A 126 ILE H A 125 ASN H 1.0 . 4.58 1026 1026 A 126 ILE HB A 126 ILE H 1.0 . 3.01 1027 1027 A 126 ILE H A 126 ILE HG2% 1.0 . 3.83 1028 1028 A 73 ILE H A 74 ILE H 1.0 . 4.80 1029 1029 A 74 ILE H A 73 ILE HA 1.0 . 3.44 1030 1030 A 74 ILE H A 74 ILE HB 1.0 . 3.66 1031 1031 A 74 ILE H A 74 ILE HG2% 1.0 . 3.35 1032 1032 A 73 ILE HD1% A 74 ILE H 1.0 . 4.11 1033 1033 A 157 LEU H A 156 CYS H 1.0 . 3.87 1034 1034 A 157 LEU H A 156 CYS HBx 1.0 . 4.55 1035 1035 A 157 LEU H A 156 CYS HBy 1.0 . 4.55 1036 1036 A 96 ASP H A 97 ASP H 1.0 . 3.77 1037 1037 A 154 LEU H A 153 LEU HA 1.0 . 3.26 1038 1038 A 73 ILE HG2% A 154 LEU H 1.0 . 4.28 1039 1039 A 117 LEU H A 117 LEU HBx 1.0 . 4.05 1040 1040 A 117 LEU HG A 117 LEU H 1.0 . 3.94 1041 1041 A 117 LEU H A 116 ASN HBx 1.0 . 4.36 1042 1042 A 117 LEU H A 116 ASN HBy 1.0 . 4.36 1043 1043 A 11 THR H A 6 GLY HAx 1.0 . 4.11 1044 1044 A 11 THR HG2% A 11 THR H 1.0 . 3.33 1045 1045 A 10 ASN HBy A 11 THR H 1.0 . 3.99 1046 1046 A 11 THR H A 6 GLY HAy 1.0 . 4.11 1047 1047 A 50 THR H A 50 THR HB 1.0 . 3.93 1048 1048 A 50 THR H A 49 TRP HA 1.0 . 3.32 1049 1049 A 51 ALA H A 50 THR HA 1.0 . 3.15 1050 1050 A 22 SER HA A 50 THR H 1.0 . 5.13 1051 1051 A 50 THR H A 148 THR HA 1.0 . 5.50 1052 1052 A 66 THR HG2% A 66 THR H 1.0 . 2.97 1053 1053 A 66 THR H A 64 LEU HBx 1.0 . 4.58 1054 1054 A 66 THR H A 64 LEU HBy 1.0 . 4.58 1055 1055 A 68 ARG H A 66 THR H 1.0 . 5.50 1056 1056 A 134 ARG HE A 66 THR H 1.0 . 5.50 1057 1057 A 64 LEU H A 66 THR H 1.0 . 5.23 1058 1058 A 67 GLN H A 66 THR H 1.0 . 4.55 1059 1059 A 65 GLY H A 66 THR H 1.0 . 3.55 1060 1060 A 71 THR H A 72 GLY H 1.0 . 3.16 1061 1061 A 71 THR H A 70 VAL HA 1.0 . 3.30 1062 1062 A 70 VAL HB A 71 THR H 1.0 . 3.34 1063 1063 A 71 THR H A 72 GLY HAx 1.0 . 4.96 1064 1064 A 71 THR H A 156 CYS HA 1.0 . 5.50 1065 1065 A 74 ILE HA A 75 THR H 1.0 . 3.16 1066 1066 A 75 THR HG2% A 75 THR H 1.0 . 4.13 1067 1067 A 74 ILE HD1% A 75 THR H 1.0 . 3.83 1068 1068 A 75 THR H A 74 ILE HB 1.0 . 4.80 1069 1069 A 76 GLN H A 75 THR HA 1.0 . 3.24 1070 1070 A 101 TRP HA A 102 THR H 1.0 . 3.28 1071 1071 A 102 THR HG2% A 102 THR H 1.0 . 4.25 1072 1072 A 102 THR HG1 A 102 THR H 1.0 . 4.39 1073 1073 A 102 THR HB A 102 THR H 1.0 . 3.18 1074 1074 A 93 ALA HB% A 102 THR H 1.0 . 4.56 1075 1075 A 95 SER HA A 102 THR H 1.0 . 4.80 1076 1076 A 93 ALA HA A 102 THR H 1.0 . 4.74 1077 1077 A 94 HIS H A 102 THR H 1.0 . 3.77 1078 1078 A 148 THR H A 147 ILE HA 1.0 . 3.28 1079 1079 A 86 TYR HA A 148 THR H 1.0 . 4.30 1080 1080 A 147 ILE HD1% A 148 THR H 1.0 . 5.50 1081 1081 A 148 THR H A 147 ILE HG2% 1.0 . 3.85 1082 1082 A 87 VAL HA A 148 THR H 1.0 . 4.99 1083 1083 A 148 THR H A 50 THR HA 1.0 . 5.06 1084 1084 A 144 HIS H A 148 THR H 1.0 . 5.50 1085 1085 A 19 ALA H A 18 SER HA 1.0 . 3.25 1086 1086 A 19 ALA H A 18 SER H 1.0 . 4.49 1087 1087 A 19 ALA HB% A 19 ALA H 1.0 . 3.19 1088 1088 A 90 TYR H A 112 VAL HB 1.0 . 3.52 1089 1089 A 19 ALA H A 35 PRO HBy 1.0 . 4.17 1090 1090 A 49 TRP HE1 A 19 ALA H 1.0 . 4.88 1091 1091 A 61 GLN H A 19 ALA H 1.0 . 4.87 1092 1092 A 19 ALA HB% A 20 SER H 1.0 . 3.05 1093 1093 A 48 ALA H A 46 ILE HG2% 1.0 . 3.48 1094 1094 A 48 ALA H A 37 LEU HDy% 1.0 . 4.35 1095 1095 A 48 ALA H A 48 ALA HB% 1.0 . 3.30 1096 1096 A 48 ALA H A 37 LEU HBx 1.0 . 4.69 1097 1097 A 48 ALA H A 37 LEU HBy 1.0 . 4.69 1098 1098 A 48 ALA H A 46 ILE HA 1.0 . 4.25 1099 1099 A 48 ALA H A 46 ILE HD1% 1.0 . 5.08 1100 1100 A 48 ALA H A 38 GLY H 1.0 . 4.94 1101 1101 A 51 ALA H A 50 THR HG2% 1.0 . 3.29 1102 1102 A 51 ALA HB% A 51 ALA H 1.0 . 3.10 1103 1103 A 50 THR H A 51 ALA H 1.0 . 4.70 1104 1104 A 56 ALA HB% A 56 ALA H 1.0 . 3.26 1105 1105 A 56 ALA H A 55 SER HBx 1.0 . 4.42 1106 1106 A 56 ALA H A 55 SER HBy 1.0 . 4.42 1107 1107 A 57 LYS H A 56 ALA H 1.0 . 4.15 1108 1108 A 78 ALA H A 85 GLN H 1.0 . 4.24 1109 1109 A 78 ALA H A 77 GLY H 1.0 . 4.69 1110 1110 A 78 ALA H A 78 ALA HB% 1.0 . 3.63 1111 1111 A 78 ALA H A 148 THR HB 1.0 . 4.16 1112 1112 A 88 ALA HB% A 88 ALA H 1.0 . 3.45 1113 1113 A 88 ALA H A 143 TRP HBx 1.0 . 4.96 1114 1114 A 88 ALA H A 143 TRP HA 1.0 . 3.71 1115 1115 A 89 SER H A 88 ALA H 1.0 . 3.15 1116 1116 A 142 SER H A 88 ALA H 1.0 . 5.20 1117 1117 A 143 TRP H A 88 ALA H 1.0 . 5.47 1118 1118 A 93 ALA H A 137 ARG H 1.0 . 3.90 1119 1119 A 93 ALA H A 92 VAL HA 1.0 . 2.95 1120 1120 A 93 ALA H A 138 VAL HA 1.0 . 4.08 1121 1121 A 139 LEU H A 93 ALA H 1.0 . 5.46 1122 1122 A 96 ASP H A 95 SER H 1.0 . 5.32 1123 1123 A 93 ALA H A 92 VAL H 1.0 . 4.65 1124 1124 A 93 ALA H A 103 VAL HA 1.0 . 5.22 1125 1125 A 133 ALA H A 132 MET HA 1.0 . 2.83 1126 1126 A 133 ALA HB% A 133 ALA H 1.0 . 3.06 1127 1127 A 133 ALA H A 70 VAL HGx% 1.0 . 4.12 1128 1128 A 133 ALA H A 132 MET HGx 1.0 . 5.50 1129 1129 A 133 ALA H A 132 MET HGy 1.0 . 5.50 1130 1130 A 133 ALA H A 132 MET H 1.0 . 4.68 1131 1131 A 49 TRP HBy A 49 TRP H 1.0 . 3.85 1132 1132 A 49 TRP H A 49 TRP HBx 1.0 . 3.70 1133 1133 A 49 TRP H A 48 ALA HB% 1.0 . 3.28 1134 1134 A 49 TRP H A 35 PRO HA 1.0 . 5.38 1135 1135 A 49 TRP H A 37 LEU H 1.0 . 4.16 1136 1136 A 49 TRP H A 149 LEU H 1.0 . 5.06 1137 1137 A 59 TRP H A 58 GLU HA 1.0 . 3.52 1138 1138 A 58 GLU H A 56 ALA H 1.0 . 5.14 1139 1139 A 59 TRP H A 20 SER HBx 1.0 . 5.46 1140 1140 A 59 TRP H A 20 SER HBy 1.0 . 5.46 1141 1141 A 59 TRP H A 58 GLU HGx 1.0 . 5.31 1142 1142 A 59 TRP H A 58 GLU HGy 1.0 . 5.31 1143 1143 A 59 TRP HA A 60 LEU H 1.0 . 3.36 1144 1144 A 60 LEU H A 59 TRP HBy 1.0 . 3.95 1145 1145 A 101 TRP H A 100 GLN HA 1.0 . 3.16 1146 1146 A 100 GLN HBy A 101 TRP H 1.0 . 4.65 1147 1147 A 101 TRP H A 100 GLN HBx 1.0 . 4.81 1148 1148 A 101 TRP H A 100 GLN HGy 1.0 . 4.99 1149 1149 A 101 TRP H A 101 TRP HBy 1.0 . 3.52 1150 1150 A 101 TRP HD1 A 101 TRP H 1.0 . 3.79 1151 1151 A 143 TRP H A 142 SER HA 1.0 . 2.92 1152 1152 A 88 ALA HB% A 143 TRP H 1.0 . 4.49 1153 1153 A 143 TRP H A 143 TRP HE1 1.0 . 5.50 1154 1154 A 143 TRP H A 87 VAL HA 1.0 . 5.02 1155 1155 A 32 GLY H A 31 PHE H 1.0 . 3.77 1156 1156 A 31 PHE H A 31 PHE HBy 1.0 . 4.20 1157 1157 A 31 PHE H A 31 PHE HBx 1.0 . 4.20 1158 1158 A 30 ALA HB% A 31 PHE H 1.0 . 3.73 1159 1159 A 81 PHE H A 81 PHE HD% 1.0 . 3.90 1160 1160 A 81 PHE H A 80 ASP HBx 1.0 . 4.80 1161 1161 A 81 PHE H A 80 ASP HBy 1.0 . 4.80 1162 1162 A 81 PHE H A 80 ASP H 1.0 . 5.07 1163 1163 A 81 PHE H A 82 GLY H 1.0 . 5.26 1164 1164 A 81 PHE H A 83 HIS H 1.0 . 5.50 1165 1165 A 113 PHE H A 112 VAL HA 1.0 . 3.11 1166 1166 A 113 PHE H A 113 PHE HBy 1.0 . 3.80 1167 1167 A 113 PHE H A 113 PHE HBx 1.0 . 3.80 1168 1168 A 113 PHE H A 112 VAL HB 1.0 . 4.19 1169 1169 A 113 PHE H A 89 SER HA 1.0 . 5.10 1170 1170 A 113 PHE H A 113 PHE HD% 1.0 . 3.53 1171 1171 A 127 PHE H A 126 ILE HA 1.0 . 3.02 1172 1172 A 127 PHE H A 128 GLU H 1.0 . 5.50 1173 1173 A 127 PHE H A 126 ILE H 1.0 . 4.65 1174 1174 A 127 PHE H A 127 PHE HBx 1.0 . 3.91 1175 1175 A 127 PHE H A 127 PHE HBy 1.0 . 3.91 1176 1176 A 127 PHE H A 127 PHE HD% 1.0 . 3.69 1177 1177 A 127 PHE H A 126 ILE HG2% 1.0 . 3.23 1178 1178 A 127 PHE H A 72 GLY HAx 1.0 . 5.10 1179 1179 A 131 PHE H A 130 PRO HA 1.0 . 2.93 1180 1180 A 70 VAL HGx% A 131 PHE H 1.0 . 4.54 1181 1181 A 70 VAL HGy% A 131 PHE H 1.0 . 3.64 1182 1182 A 131 PHE H A 130 PRO HBx 1.0 . 3.69 1183 1183 A 70 VAL H A 131 PHE H 1.0 . 3.79 1184 1184 A 132 MET H A 131 PHE H 1.0 . 4.53 1185 1185 A 85 GLN HA A 86 TYR H 1.0 . 3.05 1186 1186 A 86 TYR H A 85 GLN HBx 1.0 . 3.99 1187 1187 A 86 TYR H A 85 GLN HBy 1.0 . 3.99 1188 1188 A 87 VAL HA A 86 TYR H 1.0 . 4.68 1189 1189 A 104 TYR H A 103 VAL HA 1.0 . 3.32 1190 1190 A 68 ARG H A 67 GLN HA 1.0 . 3.07 1191 1191 A 67 GLN H A 68 ARG H 1.0 . 4.16 1192 1192 A 79 ARG H A 78 ALA HA 1.0 . 3.44 1193 1193 A 79 ARG H A 78 ALA HB% 1.0 . 3.39 1194 1194 A 79 ARG H A 79 ARG HBx 1.0 . 3.87 1195 1195 A 81 PHE H A 79 ARG H 1.0 . 5.50 1196 1196 A 10 ASN H A 11 THR H 1.0 . 3.40 1197 1197 A 134 ARG H A 133 ALA HA 1.0 . 3.37 1198 1198 A 134 ARG H A 96 ASP HA 1.0 . 3.77 1199 1199 A 96 ASP H A 134 ARG H 1.0 . 5.47 1200 1200 A 134 ARG H A 135 TYR H 1.0 . 3.33 1201 1201 A 137 ARG H A 136 VAL HA 1.0 . 3.19 1202 1202 A 14 ASP HA A 16 GLN H 1.0 . 4.36 1203 1203 A 17 MET H A 16 GLN H 1.0 . 3.29 1204 1204 A 14 ASP H A 16 GLN H 1.0 . 5.12 1205 1205 A 16 GLN H A 16 GLN HGy 1.0 . 3.86 1206 1206 A 16 GLN H A 16 GLN HGx 1.0 . 3.86 1207 1207 A 36 HIS H A 37 LEU H 1.0 . 3.43 1208 1208 A 36 HIS H A 38 GLY H 1.0 . 4.93 1209 1209 A 36 HIS H A 36 HIS HBx 1.0 . 4.12 1210 1210 A 49 TRP HBy A 36 HIS H 1.0 . 4.26 1211 1211 A 36 HIS H A 36 HIS HBy 1.0 . 4.12 1212 1212 A 36 HIS H A 37 LEU HDx% 1.0 . 4.96 1213 1213 A 35 PRO HBx A 36 HIS H 1.0 . 4.00 1214 1214 A 36 HIS H A 49 TRP HBx 1.0 . 4.38 1215 1215 A 17 MET H A 36 HIS H 1.0 . 5.15 1216 1216 A 93 ALA HA A 94 HIS H 1.0 . 3.08 1217 1217 A 94 HIS H A 103 VAL H 1.0 . 5.40 1218 1218 A 94 HIS H A 93 ALA HB% 1.0 . 3.08 1219 1219 A 94 HIS H A 103 VAL HA 1.0 . 5.16 1220 1220 A 95 SER HA A 94 HIS H 1.0 . 5.21 1221 1221 A 94 HIS H A 94 HIS HD2 1.0 . 4.43 1222 1222 A 95 SER H A 94 HIS HA 1.0 . 3.54 1223 1223 A 95 SER H A 94 HIS HBx 1.0 . 4.18 1224 1224 A 95 SER H A 94 HIS HBy 1.0 . 4.18 1225 1225 A 122 HIS H A 123 LYS H 1.0 . 4.81 1226 1226 A 122 HIS H A 121 SER H 1.0 . 4.68 1227 1227 A 122 HIS H A 122 HIS HBx 1.0 . 3.72 1228 1228 A 122 HIS H A 122 HIS HD1 1.0 . 4.86 1229 1229 A 122 HIS H A 122 HIS HD2 1.0 . 5.30 1230 1230 A 144 HIS H A 143 TRP HA 1.0 . 3.36 1231 1231 A 144 HIS H A 143 TRP HBy 1.0 . 3.84 1232 1232 A 43 GLN H A 42 ASN HA 1.0 . 2.91 1233 1233 A 43 GLN H A 43 GLN HBx 1.0 . 3.70 1234 1234 A 51 ALA HA A 52 GLN H 1.0 . 3.50 1235 1235 A 61 GLN H A 60 LEU HA 1.0 . 3.41 1236 1236 A 61 GLN H A 60 LEU H 1.0 . 4.43 1237 1237 A 61 GLN H A 61 GLN HGx 1.0 . 4.95 1238 1238 A 61 GLN H A 61 GLN HGy 1.0 . 4.95 1239 1239 A 67 GLN H A 66 THR HA 1.0 . 3.56 1240 1240 A 67 GLN H A 66 THR HG2% 1.0 . 3.70 1241 1241 A 68 ARG H A 67 GLN HGy 1.0 . 4.89 1242 1242 A 69 GLN H A 68 ARG HA 1.0 . 3.18 1243 1243 A 69 GLN H A 156 CYS H 1.0 . 4.99 1244 1244 A 76 GLN H A 150 ARG H 1.0 . 4.18 1245 1245 A 152 GLU H A 74 ILE H 1.0 . 3.94 1246 1246 A 76 GLN H A 151 LEU H 1.0 . 5.50 1247 1247 A 84 ILE HA A 85 GLN H 1.0 . 3.31 1248 1248 A 85 GLN H A 84 ILE H 1.0 . 5.26 1249 1249 A 99 VAL H A 100 GLN H 1.0 . 2.92 1250 1250 A 100 GLN H A 100 GLN HGy 1.0 . 3.59 1251 1251 A 100 GLN H A 100 GLN HBy 1.0 . 3.04 1252 1252 A 143 TRP HD1 A 144 HIS H 1.0 . 4.92 1253 1253 A 100 GLN H A 99 VAL HGx% 1.0 . 3.97 1254 1254 A 106 GLU H A 107 GLN H 1.0 . 4.85 1255 1255 A 114 GLN H A 113 PHE HA 1.0 . 2.89 1256 1256 A 114 GLN H A 114 GLN HE2x 1.0 . 4.96 1257 1257 A 114 GLN H A 113 PHE HD% 1.0 . 4.41 1258 1258 A 114 GLN H A 114 GLN HE2y 1.0 . 4.96 1259 1259 A 143 TRP HD1 A 145 ASN H 1.0 . 5.34 1260 1260 A 3 GLU H A 155 GLY H 1.0 . 3.47 1261 1261 A 3 GLU H A 2 SER H 1.0 . 4.39 1262 1262 A 3 GLU H A 2 SER HA 1.0 . 3.46 1263 1263 A 58 GLU H A 57 LYS H 1.0 . 3.31 1264 1264 A 104 TYR H A 105 GLU H 1.0 . 4.21 1265 1265 A 105 GLU H A 111 LYS H 1.0 . 5.50 1266 1266 A 111 LYS H A 109 SER H 1.0 . 5.50 1267 1267 A 105 GLU H A 106 GLU H 1.0 . 4.64 1268 1268 A 105 GLU H A 104 TYR HA 1.0 . 2.79 1269 1269 A 105 GLU H A 105 GLU HBy 1.0 . 3.66 1270 1270 A 105 GLU H A 104 TYR HBx 1.0 . 5.27 1271 1271 A 105 GLU H A 104 TYR HBy 1.0 . 5.27 1272 1272 A 106 GLU H A 105 GLU HA 1.0 . 3.05 1273 1273 A 106 GLU H A 108 GLY H 1.0 . 4.52 1274 1274 A 127 PHE HA A 128 GLU H 1.0 . 3.31 1275 1275 A 129 LYS H A 128 GLU H 1.0 . 3.83 1276 1276 A 127 PHE HD% A 128 GLU H 1.0 . 4.69 1277 1277 A 151 LEU HA A 152 GLU H 1.0 . 3.20 1278 1278 A 157 LEU H A 158 GLU H 1.0 . 3.58 1279 1279 A 158 GLU H A 158 GLU HBy 1.0 . 3.30 1280 1280 A 158 GLU H A 158 GLU HBx 1.0 . 3.30 1281 1281 A 158 GLU H A 156 CYS HBy 1.0 . 4.44 1282 1282 A 158 GLU H A 156 CYS HA 1.0 . 4.61 1283 1283 A 8 LYS H A 9 ASN H 1.0 . 3.51 1284 1284 A 9 ASN H A 9 ASN HBx 1.0 . 3.66 1285 1285 A 9 ASN H A 9 ASN HBy 1.0 . 3.66 1286 1286 A 9 ASN H A 10 ASN HD2y 1.0 . 5.01 1287 1287 A 9 ASN H A 10 ASN H 1.0 . 3.33 1288 1288 A 7 LEU H A 9 ASN H 1.0 . 4.63 1289 1289 A 10 ASN HD2y A 10 ASN H 1.0 . 3.93 1290 1290 A 10 ASN H A 10 ASN HBy 1.0 . 3.19 1291 1291 A 10 ASN H A 9 ASN HBy 1.0 . 4.71 1292 1292 A 10 ASN H A 8 LYS HA 1.0 . 5.45 1293 1293 A 7 LEU H A 10 ASN H 1.0 . 4.86 1294 1294 A 10 ASN H A 8 LYS HBx 1.0 . 4.67 1295 1295 A 41 ASP H A 42 ASN H 1.0 . 3.94 1296 1296 A 42 ASN H A 42 ASN HBx 1.0 . 3.72 1297 1297 A 42 ASN H A 42 ASN HD2x 1.0 . 4.44 1298 1298 A 42 ASN H A 42 ASN HD2y 1.0 . 4.44 1299 1299 A 47 ASN H A 46 ILE HB 1.0 . 3.99 1300 1300 A 47 ASN H A 46 ILE HD1% 1.0 . 3.79 1301 1301 A 47 ASN H A 46 ILE HG2% 1.0 . 3.61 1302 1302 A 53 SER HA A 54 ASN H 1.0 . 3.44 1303 1303 A 54 ASN H A 54 ASN HBx 1.0 . 4.01 1304 1304 A 54 ASN H A 54 ASN HBy 1.0 . 4.01 1305 1305 A 147 ILE HD1% A 54 ASN H 1.0 . 4.62 1306 1306 A 55 SER H A 54 ASN H 1.0 . 4.33 1307 1307 A 54 ASN HD2x A 54 ASN H 1.0 . 4.40 1308 1308 A 116 ASN H A 115 GLY H 1.0 . 4.06 1309 1309 A 116 ASN H A 116 ASN HBx 1.0 . 3.95 1310 1310 A 120 ASN H A 119 ASN H 1.0 . 3.57 1311 1311 A 118 ASP HA A 119 ASN H 1.0 . 3.53 1312 1312 A 84 ILE HG2% A 119 ASN H 1.0 . 3.76 1313 1313 A 84 ILE HB A 119 ASN H 1.0 . 5.50 1314 1314 A 118 ASP H A 119 ASN H 1.0 . 5.35 1315 1315 A 121 SER H A 119 ASN H 1.0 . 4.56 1316 1316 A 120 ASN H A 121 SER H 1.0 . 3.26 1317 1317 A 120 ASN H A 120 ASN HBx 1.0 . 3.83 1318 1318 A 120 ASN H A 84 ILE HG2% 1.0 . 5.10 1319 1319 A 120 ASN H A 121 SER HG 1.0 . 5.41 1320 1320 A 113 PHE H A 90 TYR H 1.0 . 3.58 1321 1321 A 73 ILE HD1% A 125 ASN H 1.0 . 3.38 1322 1322 A 14 ASP H A 13 PRO HA 1.0 . 2.88 1323 1323 A 14 ASP H A 15 SER H 1.0 . 3.42 1324 1324 A 40 LEU H A 41 ASP H 1.0 . 4.95 1325 1325 A 41 ASP H A 40 LEU HBx 1.0 . 4.75 1326 1326 A 41 ASP H A 40 LEU HBy 1.0 . 4.75 1327 1327 A 41 ASP H A 40 LEU HG 1.0 . 3.96 1328 1328 A 41 ASP H A 40 LEU HDx% 1.0 . 5.25 1329 1329 A 41 ASP H A 40 LEU HDy% 1.0 . 5.25 1330 1330 A 80 ASP H A 80 ASP HBy 1.0 . 3.69 1331 1331 A 80 ASP H A 80 ASP HBx 1.0 . 3.69 1332 1332 A 79 ARG HA A 80 ASP H 1.0 . 3.01 1333 1333 A 85 GLN H A 80 ASP H 1.0 . 4.66 1334 1334 A 80 ASP H A 83 HIS H 1.0 . 4.38 1335 1335 A 40 LEU H A 39 ARG H 1.0 . 4.67 1336 1336 A 84 ILE HA A 80 ASP H 1.0 . 4.75 1337 1337 A 80 ASP H A 83 HIS HBx 1.0 . 4.97 1338 1338 A 80 ASP H A 83 HIS HBy 1.0 . 4.97 1339 1339 A 39 ARG H A 39 ARG HDx 1.0 . 5.50 1340 1340 A 39 ARG H A 39 ARG HDy 1.0 . 5.50 1341 1341 A 39 ARG H A 39 ARG HGx 1.0 . 3.91 1342 1342 A 39 ARG H A 39 ARG HGy 1.0 . 3.91 1343 1343 A 39 ARG H A 39 ARG HBy 1.0 . 3.98 1344 1344 A 80 ASP H A 79 ARG HBy 1.0 . 4.03 1345 1345 A 96 ASP H A 95 SER HA 1.0 . 3.30 1346 1346 A 97 ASP H A 98 GLY H 1.0 . 3.28 1347 1347 A 118 ASP H A 117 LEU H 1.0 . 3.27 1348 1348 A 156 CYS H A 155 GLY HAx 1.0 . 3.29 1349 1349 A 155 GLY HAy A 156 CYS H 1.0 . 3.23 1350 1350 A 7 LEU H A 6 GLY H 1.0 . 3.11 1351 1351 A 8 LYS H A 6 GLY H 1.0 . 4.21 1352 1352 A 7 LEU HBy A 6 GLY H 1.0 . 4.35 1353 1353 A 4 PRO HGy A 6 GLY H 1.0 . 3.86 1354 1354 A 6 GLY H A 5 LEU HBy 1.0 . 5.14 1355 1355 A 6 GLY H A 5 LEU HDx% 1.0 . 4.74 1356 1356 A 32 GLY H A 31 PHE HBy 1.0 . 5.11 1357 1357 A 38 GLY H A 37 LEU H 1.0 . 3.13 1358 1358 A 49 TRP H A 38 GLY H 1.0 . 4.25 1359 1359 A 38 GLY H A 36 HIS HA 1.0 . 4.53 1360 1360 A 38 GLY H A 48 ALA HA 1.0 . 4.42 1361 1361 A 38 GLY H A 150 ARG HA 1.0 . 5.50 1362 1362 A 44 GLY H A 43 GLN HBx 1.0 . 4.33 1363 1363 A 44 GLY H A 43 GLN HBy 1.0 . 3.85 1364 1364 A 64 LEU H A 65 GLY H 1.0 . 3.67 1365 1365 A 134 ARG HE A 65 GLY H 1.0 . 4.07 1366 1366 A 65 GLY H A 64 LEU HBx 1.0 . 5.24 1367 1367 A 65 GLY H A 64 LEU HBy 1.0 . 5.24 1368 1368 A 64 LEU HG A 65 GLY H 1.0 . 4.97 1369 1369 A 72 GLY H A 155 GLY H 1.0 . 5.50 1370 1370 A 154 LEU H A 72 GLY H 1.0 . 3.87 1371 1371 A 70 VAL HB A 72 GLY H 1.0 . 3.03 1372 1372 A 73 ILE HG2% A 72 GLY H 1.0 . 4.20 1373 1373 A 154 LEU HBy A 72 GLY H 1.0 . 4.52 1374 1374 A 73 ILE H A 72 GLY H 1.0 . 4.56 1375 1375 A 73 ILE H A 72 GLY HAx 1.0 . 3.24 1376 1376 A 73 ILE H A 72 GLY HAy 1.0 . 3.24 1377 1377 A 95 SER HA A 98 GLY H 1.0 . 4.05 1378 1378 A 100 GLN H A 98 GLY H 1.0 . 4.13 1379 1379 A 96 ASP H A 98 GLY H 1.0 . 4.47 1380 1380 A 99 VAL HA A 98 GLY H 1.0 . 5.12 1381 1381 A 109 SER H A 108 GLY H 1.0 . 2.98 1382 1382 A 108 GLY H A 107 GLN HBx 1.0 . 5.36 1383 1383 A 108 GLY H A 107 GLN HBy 1.0 . 5.36 1384 1384 A 108 GLY H A 107 GLN HGx 1.0 . 4.77 1385 1385 A 108 GLY H A 107 GLN HGy 1.0 . 4.77 1386 1386 A 107 GLN H A 108 GLY H 1.0 . 4.63 1387 1387 A 115 GLY H A 114 GLN HA 1.0 . 2.98 1388 1388 A 88 ALA HB% A 115 GLY H 1.0 . 4.26 1389 1389 A 115 GLY H A 114 GLN HBx 1.0 . 3.93 1390 1390 A 115 GLY H A 114 GLN HGx 1.0 . 5.05 1391 1391 A 115 GLY H A 114 GLN HGy 1.0 . 5.05 1392 1392 A 154 LEU HBy A 155 GLY H 1.0 . 3.95 1393 1393 A 132 MET H A 131 PHE HA 1.0 . 3.02 1394 1394 A 1 CYS HA A 156 CYS HBx 1.0 . 4.20 1395 1394 A 1 CYS HA A 156 CYS HBy 1.0 . 4.20 1396 1395 A 2 SER HA A 154 LEU HDy% 1.0 . 4.16 1397 1395 A 2 SER HA A 154 LEU HDx% 1.0 . 4.16 1398 1396 A 3 GLU H A 2 SER HBy 1.0 . 4.10 1399 1396 A 3 GLU H A 2 SER HBx 1.0 . 4.10 1400 1397 A 154 LEU HBx A 2 SER HBy 1.0 . 3.97 1401 1397 A 154 LEU HBx A 2 SER HBx 1.0 . 3.97 1402 1398 A 2 SER HBx A 154 LEU HDy% 1.0 . 3.88 1403 1398 A 2 SER HBy A 154 LEU HDy% 1.0 . 3.88 1404 1398 A 154 LEU HDx% A 2 SER HBy 1.0 . 3.88 1405 1398 A 154 LEU HDx% A 2 SER HBx 1.0 . 3.88 1406 1399 A 3 GLU H A 3 GLU HBy 1.0 . 3.19 1407 1399 A 3 GLU H A 3 GLU HBx 1.0 . 3.19 1408 1400 A 3 GLU H A 3 GLU HGx 1.0 . 3.11 1409 1400 A 3 GLU H A 3 GLU HGy 1.0 . 3.11 1410 1401 A 3 GLU H A 4 PRO HDy 1.0 . 4.79 1411 1401 A 3 GLU H A 4 PRO HDx 1.0 . 4.79 1412 1402 A 3 GLU H A 154 LEU HDy% 1.0 . 4.04 1413 1402 A 3 GLU H A 154 LEU HDx% 1.0 . 4.04 1414 1403 A 3 GLU H A 157 LEU HDy% 1.0 . 5.44 1415 1403 A 3 GLU H A 157 LEU HDx% 1.0 . 5.44 1416 1404 A 155 GLY H A 3 GLU HBy 1.0 . 4.65 1417 1404 A 155 GLY H A 3 GLU HBx 1.0 . 4.65 1418 1405 A 157 LEU H A 3 GLU HBy 1.0 . 4.98 1419 1405 A 157 LEU H A 3 GLU HBx 1.0 . 4.98 1420 1406 A 3 GLU HBy A 157 LEU HDy% 1.0 . 3.63 1421 1406 A 3 GLU HBx A 157 LEU HDy% 1.0 . 3.63 1422 1406 A 157 LEU HDx% A 3 GLU HBy 1.0 . 3.63 1423 1406 A 3 GLU HBx A 157 LEU HDx% 1.0 . 3.63 1424 1407 A 155 GLY H A 3 GLU HGx 1.0 . 4.61 1425 1407 A 155 GLY H A 3 GLU HGy 1.0 . 4.61 1426 1408 A 3 GLU HGx A 157 LEU HBx 1.0 . 4.36 1427 1408 A 3 GLU HGy A 157 LEU HBx 1.0 . 4.36 1428 1408 A 157 LEU HBy A 3 GLU HGx 1.0 . 4.36 1429 1408 A 3 GLU HGy A 157 LEU HBy 1.0 . 4.36 1430 1409 A 157 LEU HG A 3 GLU HGx 1.0 . 4.56 1431 1409 A 157 LEU HG A 3 GLU HGy 1.0 . 4.56 1432 1410 A 3 GLU HGx A 157 LEU HDy% 1.0 . 3.35 1433 1410 A 3 GLU HGy A 157 LEU HDy% 1.0 . 3.35 1434 1410 A 157 LEU HDx% A 3 GLU HGx 1.0 . 3.35 1435 1410 A 3 GLU HGy A 157 LEU HDx% 1.0 . 3.35 1436 1411 A 4 PRO HA A 5 LEU HDy% 1.0 . 4.85 1437 1411 A 4 PRO HA A 5 LEU HDx% 1.0 . 4.85 1438 1412 A 4 PRO HA A 153 LEU HDx% 1.0 . 5.44 1439 1412 A 4 PRO HA A 153 LEU HDy% 1.0 . 5.44 1440 1413 A 4 PRO HA A 154 LEU HDy% 1.0 . 3.38 1441 1413 A 4 PRO HA A 154 LEU HDx% 1.0 . 3.38 1442 1414 A 5 LEU H A 4 PRO HBy 1.0 . 3.81 1443 1414 A 5 LEU H A 4 PRO HBx 1.0 . 3.81 1444 1415 A 6 GLY H A 4 PRO HBy 1.0 . 4.10 1445 1415 A 6 GLY H A 4 PRO HBx 1.0 . 4.10 1446 1416 A 4 PRO HBy A 154 LEU HDy% 1.0 . 4.83 1447 1416 A 4 PRO HBx A 154 LEU HDy% 1.0 . 4.83 1448 1416 A 154 LEU HDx% A 4 PRO HBy 1.0 . 4.83 1449 1416 A 154 LEU HDx% A 4 PRO HBx 1.0 . 4.83 1450 1417 A 5 LEU H A 5 LEU HDy% 1.0 . 3.27 1451 1417 A 5 LEU H A 5 LEU HDx% 1.0 . 3.27 1452 1418 A 5 LEU HA A 5 LEU HDy% 1.0 . 4.09 1453 1418 A 5 LEU HA A 5 LEU HDx% 1.0 . 4.09 1454 1419 A 5 LEU HA A 6 GLY HAx 1.0 . 5.17 1455 1419 A 5 LEU HA A 6 GLY HAy 1.0 . 5.17 1456 1420 A 6 GLY H A 5 LEU HBx 1.0 . 4.26 1457 1420 A 6 GLY H A 5 LEU HBy 1.0 . 4.26 1458 1421 A 5 LEU HBx A 6 GLY HAx 1.0 . 5.18 1459 1421 A 5 LEU HBy A 6 GLY HAx 1.0 . 5.18 1460 1421 A 6 GLY HAy A 5 LEU HBx 1.0 . 5.18 1461 1421 A 6 GLY HAy A 5 LEU HBy 1.0 . 5.18 1462 1422 A 6 GLY H A 5 LEU HDy% 1.0 . 3.70 1463 1422 A 6 GLY H A 5 LEU HDx% 1.0 . 3.70 1464 1423 A 5 LEU HDx% A 6 GLY HAx 1.0 . 3.88 1465 1423 A 5 LEU HDy% A 6 GLY HAx 1.0 . 3.88 1466 1423 A 6 GLY HAy A 5 LEU HDy% 1.0 . 3.88 1467 1423 A 5 LEU HDx% A 6 GLY HAy 1.0 . 3.88 1468 1424 A 7 LEU H A 5 LEU HDy% 1.0 . 4.20 1469 1424 A 7 LEU H A 5 LEU HDx% 1.0 . 4.20 1470 1425 A 7 LEU HA A 5 LEU HDy% 1.0 . 5.06 1471 1425 A 7 LEU HA A 5 LEU HDx% 1.0 . 5.06 1472 1426 A 12 ILE H A 5 LEU HDy% 1.0 . 5.05 1473 1426 A 12 ILE H A 5 LEU HDx% 1.0 . 5.05 1474 1427 A 39 ARG HA A 5 LEU HDy% 1.0 . 5.16 1475 1427 A 39 ARG HA A 5 LEU HDx% 1.0 . 5.16 1476 1428 A 39 ARG HBx A 5 LEU HDy% 1.0 . 4.85 1477 1428 A 39 ARG HBx A 5 LEU HDx% 1.0 . 4.85 1478 1429 A 39 ARG HBy A 5 LEU HDy% 1.0 . 5.20 1479 1429 A 39 ARG HBy A 5 LEU HDx% 1.0 . 5.20 1480 1430 A 6 GLY H A 7 LEU HDy% 1.0 . 4.24 1481 1430 A 6 GLY H A 7 LEU HDx% 1.0 . 4.24 1482 1431 A 8 LYS H A 6 GLY HAx 1.0 . 4.55 1483 1431 A 8 LYS H A 6 GLY HAy 1.0 . 4.55 1484 1432 A 10 ASN HBy A 6 GLY HAx 1.0 . 4.77 1485 1432 A 10 ASN HBy A 6 GLY HAy 1.0 . 4.77 1486 1433 A 11 THR H A 6 GLY HAx 1.0 . 3.45 1487 1433 A 11 THR H A 6 GLY HAy 1.0 . 3.45 1488 1434 A 11 THR HB A 6 GLY HAx 1.0 . 4.92 1489 1434 A 6 GLY HAy A 11 THR HB 1.0 . 4.92 1490 1435 A 11 THR HG2% A 6 GLY HAx 1.0 . 4.33 1491 1435 A 11 THR HG2% A 6 GLY HAy 1.0 . 4.33 1492 1436 A 12 ILE H A 6 GLY HAx 1.0 . 3.68 1493 1436 A 12 ILE H A 6 GLY HAy 1.0 . 3.68 1494 1437 A 6 GLY HAx A 12 ILE HG1y 1.0 . 4.31 1495 1437 A 6 GLY HAy A 12 ILE HG1y 1.0 . 4.31 1496 1437 A 12 ILE HG1x A 6 GLY HAx 1.0 . 4.31 1497 1437 A 6 GLY HAy A 12 ILE HG1x 1.0 . 4.31 1498 1438 A 7 LEU H A 7 LEU HDy% 1.0 . 3.59 1499 1438 A 7 LEU H A 7 LEU HDx% 1.0 . 3.59 1500 1439 A 7 LEU HA A 7 LEU HDy% 1.0 . 3.41 1501 1439 A 7 LEU HA A 7 LEU HDx% 1.0 . 3.41 1502 1440 A 8 LYS H A 7 LEU HDy% 1.0 . 4.92 1503 1440 A 8 LYS H A 7 LEU HDx% 1.0 . 4.92 1504 1441 A 39 ARG HA A 7 LEU HDy% 1.0 . 4.76 1505 1441 A 39 ARG HA A 7 LEU HDx% 1.0 . 4.76 1506 1442 A 39 ARG HBx A 7 LEU HDy% 1.0 . 3.94 1507 1442 A 39 ARG HBx A 7 LEU HDx% 1.0 . 3.94 1508 1443 A 40 LEU H A 7 LEU HDy% 1.0 . 4.11 1509 1443 A 40 LEU H A 7 LEU HDx% 1.0 . 4.11 1510 1444 A 7 LEU HDy% A 40 LEU HBy 1.0 . 3.60 1511 1444 A 7 LEU HDx% A 40 LEU HBy 1.0 . 3.60 1512 1444 A 40 LEU HBx A 7 LEU HDy% 1.0 . 3.60 1513 1444 A 7 LEU HDx% A 40 LEU HBx 1.0 . 3.60 1514 1445 A 9 ASN HA A 9 ASN HD2x 1.0 . 4.16 1515 1445 A 9 ASN HA A 9 ASN HD2y 1.0 . 4.16 1516 1446 A 10 ASN H A 9 ASN HBx 1.0 . 4.03 1517 1446 A 10 ASN H A 9 ASN HBy 1.0 . 4.03 1518 1447 A 10 ASN HD2y A 9 ASN HBx 1.0 . 4.14 1519 1447 A 10 ASN HD2y A 9 ASN HBy 1.0 . 4.14 1520 1448 A 12 ILE H A 12 ILE HG1y 1.0 . 3.62 1521 1448 A 12 ILE H A 12 ILE HG1x 1.0 . 3.62 1522 1449 A 12 ILE HG2% A 16 GLN HGy 1.0 . 5.32 1523 1449 A 12 ILE HG2% A 16 GLN HGx 1.0 . 5.32 1524 1450 A 14 ASP H A 36 HIS HBx 1.0 . 5.34 1525 1450 A 14 ASP H A 36 HIS HBy 1.0 . 5.34 1526 1451 A 14 ASP HA A 16 GLN HBx 1.0 . 5.34 1527 1451 A 14 ASP HA A 16 GLN HBy 1.0 . 5.34 1528 1452 A 14 ASP HA A 17 MET HBy 1.0 . 5.34 1529 1452 A 14 ASP HA A 17 MET HBx 1.0 . 5.34 1530 1453 A 14 ASP HBx A 36 HIS HBx 1.0 . 4.16 1531 1453 A 14 ASP HBy A 36 HIS HBx 1.0 . 4.16 1532 1453 A 36 HIS HBy A 14 ASP HBx 1.0 . 4.16 1533 1453 A 36 HIS HBy A 14 ASP HBy 1.0 . 4.16 1534 1454 A 15 SER H A 15 SER HBy 1.0 . 3.26 1535 1454 A 15 SER H A 15 SER HBx 1.0 . 3.26 1536 1455 A 16 GLN H A 16 GLN HBx 1.0 . 3.22 1537 1455 A 16 GLN H A 16 GLN HBy 1.0 . 3.22 1538 1456 A 16 GLN H A 16 GLN HGy 1.0 . 3.30 1539 1456 A 16 GLN H A 16 GLN HGx 1.0 . 3.30 1540 1457 A 16 GLN H A 62 VAL HGx% 1.0 . 4.87 1541 1457 A 16 GLN H A 62 VAL HGy% 1.0 . 4.87 1542 1458 A 16 GLN HA A 16 GLN HGy 1.0 . 3.67 1543 1458 A 16 GLN HGx A 16 GLN HA 1.0 . 3.67 1544 1459 A 17 MET H A 16 GLN HGy 1.0 . 3.23 1545 1459 A 17 MET H A 16 GLN HGx 1.0 . 3.23 1546 1460 A 17 MET HA A 16 GLN HGy 1.0 . 4.25 1547 1460 A 17 MET HA A 16 GLN HGx 1.0 . 4.25 1548 1461 A 16 GLN HGy A 17 MET HBy 1.0 . 4.03 1549 1461 A 16 GLN HGx A 17 MET HBy 1.0 . 4.03 1550 1461 A 17 MET HBx A 16 GLN HGy 1.0 . 4.03 1551 1461 A 16 GLN HGx A 17 MET HBx 1.0 . 4.03 1552 1462 A 36 HIS H A 16 GLN HGy 1.0 . 5.34 1553 1462 A 36 HIS H A 16 GLN HGx 1.0 . 5.34 1554 1463 A 36 HIS HA A 16 GLN HGy 1.0 . 4.81 1555 1463 A 36 HIS HA A 16 GLN HGx 1.0 . 4.81 1556 1464 A 16 GLN HGy A 36 HIS HBx 1.0 . 4.28 1557 1464 A 16 GLN HGx A 36 HIS HBx 1.0 . 4.28 1558 1464 A 36 HIS HBy A 16 GLN HGy 1.0 . 4.28 1559 1464 A 16 GLN HGx A 36 HIS HBy 1.0 . 4.28 1560 1465 A 16 GLN HGx A 62 VAL HGx% 1.0 . 4.29 1561 1465 A 16 GLN HGy A 62 VAL HGx% 1.0 . 4.29 1562 1465 A 62 VAL HGy% A 16 GLN HGy 1.0 . 4.29 1563 1465 A 16 GLN HGx A 62 VAL HGy% 1.0 . 4.29 1564 1466 A 17 MET H A 17 MET HBy 1.0 . 3.44 1565 1466 A 17 MET H A 17 MET HBx 1.0 . 3.44 1566 1467 A 17 MET H A 36 HIS HBx 1.0 . 4.56 1567 1467 A 17 MET H A 36 HIS HBy 1.0 . 4.56 1568 1468 A 17 MET H A 62 VAL HGx% 1.0 . 4.04 1569 1468 A 17 MET H A 62 VAL HGy% 1.0 . 4.04 1570 1469 A 18 SER H A 17 MET HBy 1.0 . 3.90 1571 1469 A 18 SER H A 17 MET HBx 1.0 . 3.90 1572 1470 A 18 SER HA A 17 MET HBy 1.0 . 4.44 1573 1470 A 18 SER HA A 17 MET HBx 1.0 . 4.44 1574 1471 A 35 PRO HA A 17 MET HBy 1.0 . 4.78 1575 1471 A 35 PRO HA A 17 MET HBx 1.0 . 4.78 1576 1472 A 36 HIS H A 17 MET HBy 1.0 . 3.49 1577 1472 A 36 HIS H A 17 MET HBx 1.0 . 3.49 1578 1473 A 36 HIS HA A 17 MET HBy 1.0 . 3.68 1579 1473 A 36 HIS HA A 17 MET HBx 1.0 . 3.68 1580 1474 A 17 MET HBx A 36 HIS HBx 1.0 . 4.16 1581 1474 A 17 MET HBy A 36 HIS HBx 1.0 . 4.16 1582 1474 A 36 HIS HBy A 17 MET HBy 1.0 . 4.16 1583 1474 A 36 HIS HBy A 17 MET HBx 1.0 . 4.16 1584 1475 A 17 MET HBy A 60 LEU HDy% 1.0 . 4.18 1585 1475 A 60 LEU HDx% A 17 MET HBy 1.0 . 4.18 1586 1475 A 17 MET HBx A 60 LEU HDx% 1.0 . 4.18 1587 1475 A 17 MET HBx A 60 LEU HDy% 1.0 . 4.18 1588 1476 A 18 SER H A 17 MET HGx 1.0 . 4.59 1589 1476 A 18 SER H A 17 MET HGy 1.0 . 4.59 1590 1477 A 18 SER H A 18 SER HBx 1.0 . 3.59 1591 1477 A 18 SER H A 18 SER HBy 1.0 . 3.59 1592 1478 A 18 SER H A 60 LEU HDy% 1.0 . 4.31 1593 1478 A 18 SER H A 60 LEU HDx% 1.0 . 4.31 1594 1479 A 18 SER H A 62 VAL HGx% 1.0 . 4.64 1595 1479 A 18 SER H A 62 VAL HGy% 1.0 . 4.64 1596 1480 A 19 ALA H A 18 SER HBx 1.0 . 3.43 1597 1480 A 19 ALA H A 18 SER HBy 1.0 . 3.43 1598 1481 A 19 ALA H A 60 LEU HDy% 1.0 . 3.90 1599 1481 A 19 ALA H A 60 LEU HDx% 1.0 . 3.90 1600 1482 A 19 ALA H A 61 GLN HE2y 1.0 . 4.97 1601 1482 A 19 ALA H A 61 GLN HE2x 1.0 . 4.97 1602 1483 A 19 ALA HA A 60 LEU HDy% 1.0 . 4.23 1603 1483 A 19 ALA HA A 60 LEU HDx% 1.0 . 4.23 1604 1484 A 19 ALA HA A 61 GLN HE2y 1.0 . 4.32 1605 1484 A 19 ALA HA A 61 GLN HE2x 1.0 . 4.32 1606 1485 A 19 ALA HB% A 60 LEU HDy% 1.0 . 3.07 1607 1485 A 19 ALA HB% A 60 LEU HDx% 1.0 . 3.07 1608 1486 A 20 SER H A 20 SER HBy 1.0 . 3.56 1609 1486 A 20 SER H A 20 SER HBx 1.0 . 3.56 1610 1487 A 20 SER H A 60 LEU HDy% 1.0 . 4.95 1611 1487 A 20 SER H A 60 LEU HDx% 1.0 . 4.95 1612 1488 A 20 SER H A 61 GLN HE2y 1.0 . 4.67 1613 1488 A 20 SER H A 61 GLN HE2x 1.0 . 4.67 1614 1489 A 21 SER H A 20 SER HBy 1.0 . 3.96 1615 1489 A 21 SER H A 20 SER HBx 1.0 . 3.96 1616 1490 A 59 TRP H A 20 SER HBy 1.0 . 4.72 1617 1490 A 59 TRP H A 20 SER HBx 1.0 . 4.72 1618 1491 A 59 TRP HE1 A 20 SER HBy 1.0 . 3.92 1619 1491 A 59 TRP HE1 A 20 SER HBx 1.0 . 3.92 1620 1492 A 21 SER H A 21 SER HBx 1.0 . 3.55 1621 1492 A 21 SER H A 21 SER HBy 1.0 . 3.55 1622 1493 A 21 SER H A 52 GLN HBx 1.0 . 4.08 1623 1493 A 21 SER H A 52 GLN HBy 1.0 . 4.08 1624 1494 A 21 SER HA A 52 GLN HBx 1.0 . 4.22 1625 1494 A 21 SER HA A 52 GLN HBy 1.0 . 4.22 1626 1495 A 22 SER H A 21 SER HBx 1.0 . 3.31 1627 1495 A 22 SER H A 21 SER HBy 1.0 . 3.31 1628 1496 A 52 GLN H A 21 SER HBx 1.0 . 4.86 1629 1496 A 52 GLN H A 21 SER HBy 1.0 . 4.86 1630 1497 A 21 SER HBx A 52 GLN HBx 1.0 . 3.75 1631 1497 A 21 SER HBy A 52 GLN HBx 1.0 . 3.75 1632 1497 A 52 GLN HBy A 21 SER HBx 1.0 . 3.75 1633 1497 A 21 SER HBy A 52 GLN HBy 1.0 . 3.75 1634 1498 A 22 SER H A 22 SER HBx 1.0 . 3.61 1635 1498 A 22 SER H A 22 SER HBy 1.0 . 3.61 1636 1499 A 22 SER H A 52 GLN HBx 1.0 . 3.83 1637 1499 A 22 SER H A 52 GLN HBy 1.0 . 3.83 1638 1500 A 23 TYR H A 22 SER HBx 1.0 . 3.65 1639 1500 A 23 TYR H A 22 SER HBy 1.0 . 3.65 1640 1501 A 49 TRP HE1 A 22 SER HBx 1.0 . 4.42 1641 1501 A 49 TRP HE1 A 22 SER HBy 1.0 . 4.42 1642 1502 A 50 THR H A 22 SER HBx 1.0 . 3.83 1643 1502 A 50 THR H A 22 SER HBy 1.0 . 3.83 1644 1503 A 50 THR HB A 22 SER HBx 1.0 . 4.45 1645 1503 A 50 THR HB A 22 SER HBy 1.0 . 4.45 1646 1504 A 50 THR H A 23 TYR HBy 1.0 . 5.08 1647 1504 A 50 THR H A 23 TYR HBx 1.0 . 5.08 1648 1505 A 50 THR HG2% A 23 TYR HBy 1.0 . 3.48 1649 1505 A 50 THR HG2% A 23 TYR HBx 1.0 . 3.48 1650 1506 A 51 ALA H A 23 TYR HBy 1.0 . 4.22 1651 1506 A 51 ALA H A 23 TYR HBx 1.0 . 4.22 1652 1507 A 24 LYS H A 24 LYS HEy 1.0 . 4.63 1653 1507 A 24 LYS H A 24 LYS HEx 1.0 . 4.63 1654 1508 A 30 ALA HB% A 32 GLY HAy 1.0 . 4.07 1655 1508 A 30 ALA HB% A 32 GLY HAx 1.0 . 4.07 1656 1509 A 31 PHE H A 31 PHE HBy 1.0 . 3.63 1657 1509 A 31 PHE H A 31 PHE HBx 1.0 . 3.63 1658 1510 A 32 GLY H A 31 PHE HBy 1.0 . 4.39 1659 1510 A 32 GLY H A 31 PHE HBx 1.0 . 4.39 1660 1511 A 35 PRO HA A 60 LEU HDy% 1.0 . 4.93 1661 1511 A 35 PRO HA A 60 LEU HDx% 1.0 . 4.93 1662 1512 A 35 PRO HGx A 60 LEU HDy% 1.0 . 4.77 1663 1512 A 35 PRO HGx A 60 LEU HDx% 1.0 . 4.77 1664 1513 A 36 HIS H A 36 HIS HBx 1.0 . 3.55 1665 1513 A 36 HIS H A 36 HIS HBy 1.0 . 3.55 1666 1514 A 36 HIS H A 37 LEU HDy% 1.0 . 3.92 1667 1514 A 36 HIS H A 37 LEU HDx% 1.0 . 3.92 1668 1515 A 36 HIS HA A 60 LEU HDy% 1.0 . 5.44 1669 1515 A 36 HIS HA A 60 LEU HDx% 1.0 . 5.44 1670 1516 A 37 LEU H A 37 LEU HBy 1.0 . 3.39 1671 1516 A 37 LEU H A 37 LEU HBx 1.0 . 3.39 1672 1517 A 37 LEU H A 37 LEU HDy% 1.0 . 3.20 1673 1517 A 37 LEU H A 37 LEU HDx% 1.0 . 3.20 1674 1518 A 37 LEU H A 38 GLY HAx 1.0 . 5.21 1675 1518 A 37 LEU H A 38 GLY HAy 1.0 . 5.21 1676 1519 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.12 1677 1519 A 37 LEU HA A 37 LEU HDx% 1.0 . 3.12 1678 1520 A 37 LEU HA A 38 GLY HAx 1.0 . 5.23 1679 1520 A 37 LEU HA A 38 GLY HAy 1.0 . 5.23 1680 1521 A 37 LEU HBy A 38 GLY HAx 1.0 . 4.75 1681 1521 A 37 LEU HBx A 38 GLY HAx 1.0 . 4.75 1682 1521 A 38 GLY HAy A 37 LEU HBy 1.0 . 4.75 1683 1521 A 37 LEU HBx A 38 GLY HAy 1.0 . 4.75 1684 1522 A 46 ILE HG2% A 37 LEU HBy 1.0 . 4.23 1685 1522 A 46 ILE HG2% A 37 LEU HBx 1.0 . 4.23 1686 1523 A 47 ASN HA A 37 LEU HBy 1.0 . 4.72 1687 1523 A 47 ASN HA A 37 LEU HBx 1.0 . 4.72 1688 1524 A 48 ALA H A 37 LEU HBy 1.0 . 3.96 1689 1524 A 48 ALA H A 37 LEU HBx 1.0 . 3.96 1690 1525 A 49 TRP H A 37 LEU HBy 1.0 . 3.87 1691 1525 A 49 TRP H A 37 LEU HBx 1.0 . 3.87 1692 1526 A 38 GLY H A 37 LEU HDy% 1.0 . 4.29 1693 1526 A 38 GLY H A 37 LEU HDx% 1.0 . 4.29 1694 1527 A 37 LEU HDx% A 38 GLY HAx 1.0 . 5.28 1695 1527 A 37 LEU HDy% A 38 GLY HAx 1.0 . 5.28 1696 1527 A 38 GLY HAy A 37 LEU HDy% 1.0 . 5.28 1697 1527 A 37 LEU HDx% A 38 GLY HAy 1.0 . 5.28 1698 1528 A 46 ILE HG2% A 37 LEU HDy% 1.0 . 2.99 1699 1528 A 46 ILE HG2% A 37 LEU HDx% 1.0 . 2.99 1700 1529 A 47 ASN H A 37 LEU HDy% 1.0 . 4.44 1701 1529 A 47 ASN H A 37 LEU HDx% 1.0 . 4.44 1702 1530 A 47 ASN HA A 37 LEU HDy% 1.0 . 5.28 1703 1530 A 47 ASN HA A 37 LEU HDx% 1.0 . 5.28 1704 1531 A 48 ALA H A 37 LEU HDy% 1.0 . 3.49 1705 1531 A 48 ALA H A 37 LEU HDx% 1.0 . 3.49 1706 1532 A 48 ALA HA A 37 LEU HDy% 1.0 . 4.76 1707 1532 A 48 ALA HA A 37 LEU HDx% 1.0 . 4.76 1708 1533 A 49 TRP H A 37 LEU HDy% 1.0 . 3.92 1709 1533 A 49 TRP H A 37 LEU HDx% 1.0 . 3.92 1710 1534 A 50 THR H A 37 LEU HDy% 1.0 . 3.88 1711 1534 A 50 THR H A 37 LEU HDx% 1.0 . 3.88 1712 1535 A 38 GLY H A 39 ARG HGy 1.0 . 5.20 1713 1535 A 38 GLY H A 39 ARG HGx 1.0 . 5.20 1714 1536 A 38 GLY H A 150 ARG HGy 1.0 . 4.64 1715 1536 A 38 GLY H A 150 ARG HGx 1.0 . 4.64 1716 1537 A 48 ALA HA A 38 GLY HAx 1.0 . 3.94 1717 1537 A 48 ALA HA A 38 GLY HAy 1.0 . 3.94 1718 1538 A 48 ALA HB% A 38 GLY HAx 1.0 . 4.88 1719 1538 A 48 ALA HB% A 38 GLY HAy 1.0 . 4.88 1720 1539 A 49 TRP H A 38 GLY HAx 1.0 . 5.03 1721 1539 A 49 TRP H A 38 GLY HAy 1.0 . 5.03 1722 1540 A 150 ARG HA A 38 GLY HAx 1.0 . 4.29 1723 1540 A 150 ARG HA A 38 GLY HAy 1.0 . 4.29 1724 1541 A 38 GLY HAx A 150 ARG HGy 1.0 . 4.53 1725 1541 A 38 GLY HAy A 150 ARG HGy 1.0 . 4.53 1726 1541 A 150 ARG HGx A 38 GLY HAx 1.0 . 4.53 1727 1541 A 38 GLY HAy A 150 ARG HGx 1.0 . 4.53 1728 1542 A 39 ARG H A 39 ARG HGy 1.0 . 3.29 1729 1542 A 39 ARG H A 39 ARG HGx 1.0 . 3.29 1730 1543 A 39 ARG HBx A 39 ARG HDy 1.0 . 3.63 1731 1543 A 39 ARG HBx A 39 ARG HDx 1.0 . 3.63 1732 1544 A 40 LEU H A 39 ARG HDy 1.0 . 4.56 1733 1544 A 40 LEU H A 39 ARG HDx 1.0 . 4.56 1734 1545 A 39 ARG HDy A 42 ASN HBx 1.0 . 4.74 1735 1545 A 39 ARG HDx A 42 ASN HBx 1.0 . 4.74 1736 1545 A 42 ASN HBy A 39 ARG HDy 1.0 . 4.74 1737 1545 A 39 ARG HDx A 42 ASN HBy 1.0 . 4.74 1738 1546 A 40 LEU H A 40 LEU HBy 1.0 . 3.44 1739 1546 A 40 LEU H A 40 LEU HBx 1.0 . 3.44 1740 1547 A 41 ASP H A 40 LEU HBy 1.0 . 4.16 1741 1547 A 41 ASP H A 40 LEU HBx 1.0 . 4.16 1742 1548 A 40 LEU HBx A 41 ASP HBy 1.0 . 4.63 1743 1548 A 40 LEU HBy A 41 ASP HBy 1.0 . 4.63 1744 1548 A 41 ASP HBx A 40 LEU HBy 1.0 . 4.63 1745 1548 A 40 LEU HBx A 41 ASP HBx 1.0 . 4.63 1746 1549 A 40 LEU HG A 41 ASP HBy 1.0 . 4.53 1747 1549 A 40 LEU HG A 41 ASP HBx 1.0 . 4.53 1748 1550 A 41 ASP H A 40 LEU HDy% 1.0 . 4.37 1749 1550 A 41 ASP H A 40 LEU HDx% 1.0 . 4.37 1750 1551 A 41 ASP H A 42 ASN HD2y 1.0 . 4.19 1751 1551 A 41 ASP H A 42 ASN HD2x 1.0 . 4.19 1752 1552 A 42 ASN H A 42 ASN HD2x 1.0 . 3.70 1753 1552 A 42 ASN H A 42 ASN HD2y 1.0 . 3.70 1754 1553 A 42 ASN H A 47 ASN HBy 1.0 . 5.05 1755 1553 A 42 ASN H A 47 ASN HBx 1.0 . 5.05 1756 1554 A 42 ASN HA A 47 ASN HBy 1.0 . 4.81 1757 1554 A 42 ASN HA A 47 ASN HBx 1.0 . 4.81 1758 1555 A 43 GLN H A 42 ASN HBx 1.0 . 3.99 1759 1555 A 43 GLN H A 42 ASN HBy 1.0 . 3.99 1760 1556 A 47 ASN HA A 42 ASN HBx 1.0 . 4.28 1761 1556 A 47 ASN HA A 42 ASN HBy 1.0 . 4.28 1762 1557 A 42 ASN HBx A 47 ASN HBy 1.0 . 4.72 1763 1557 A 42 ASN HBy A 47 ASN HBy 1.0 . 4.72 1764 1557 A 47 ASN HBx A 42 ASN HBx 1.0 . 4.72 1765 1557 A 42 ASN HBy A 47 ASN HBx 1.0 . 4.72 1766 1558 A 48 ALA H A 42 ASN HBx 1.0 . 5.34 1767 1558 A 48 ALA H A 42 ASN HBy 1.0 . 5.34 1768 1559 A 43 GLN H A 43 GLN HGx 1.0 . 3.12 1769 1559 A 43 GLN H A 43 GLN HGy 1.0 . 3.12 1770 1560 A 43 GLN H A 44 GLY HAx 1.0 . 5.04 1771 1560 A 43 GLN H A 44 GLY HAy 1.0 . 5.04 1772 1561 A 43 GLN HA A 44 GLY HAx 1.0 . 5.27 1773 1561 A 43 GLN HA A 44 GLY HAy 1.0 . 5.27 1774 1562 A 44 GLY H A 43 GLN HGx 1.0 . 3.85 1775 1562 A 44 GLY H A 43 GLN HGy 1.0 . 3.85 1776 1563 A 43 GLN HGx A 44 GLY HAx 1.0 . 3.94 1777 1563 A 43 GLN HGy A 44 GLY HAx 1.0 . 3.94 1778 1563 A 44 GLY HAy A 43 GLN HGx 1.0 . 3.94 1779 1563 A 43 GLN HGy A 44 GLY HAy 1.0 . 3.94 1780 1564 A 44 GLY H A 45 LYS HDx 1.0 . 5.34 1781 1564 A 44 GLY H A 45 LYS HDy 1.0 . 5.34 1782 1565 A 44 GLY HAy A 45 LYS HDx 1.0 . 4.32 1783 1565 A 44 GLY HAx A 45 LYS HDx 1.0 . 4.32 1784 1565 A 45 LYS HDy A 44 GLY HAx 1.0 . 4.32 1785 1565 A 44 GLY HAy A 45 LYS HDy 1.0 . 4.32 1786 1566 A 46 ILE H A 44 GLY HAx 1.0 . 4.09 1787 1566 A 46 ILE H A 44 GLY HAy 1.0 . 4.09 1788 1567 A 46 ILE HD1% A 44 GLY HAx 1.0 . 4.07 1789 1567 A 46 ILE HD1% A 44 GLY HAy 1.0 . 4.07 1790 1568 A 45 LYS H A 45 LYS HGy 1.0 . 3.95 1791 1568 A 45 LYS H A 45 LYS HGx 1.0 . 3.95 1792 1569 A 45 LYS H A 45 LYS HDx 1.0 . 3.23 1793 1569 A 45 LYS H A 45 LYS HDy 1.0 . 3.23 1794 1570 A 45 LYS HA A 45 LYS HDx 1.0 . 4.03 1795 1570 A 45 LYS HA A 45 LYS HDy 1.0 . 4.03 1796 1571 A 45 LYS HA A 46 ILE HG1x 1.0 . 5.34 1797 1571 A 45 LYS HA A 46 ILE HG1y 1.0 . 5.34 1798 1572 A 46 ILE HA A 45 LYS HGy 1.0 . 4.35 1799 1572 A 46 ILE HA A 45 LYS HGx 1.0 . 4.35 1800 1573 A 46 ILE H A 45 LYS HDx 1.0 . 2.90 1801 1573 A 46 ILE H A 45 LYS HDy 1.0 . 2.90 1802 1574 A 46 ILE HA A 45 LYS HDx 1.0 . 4.41 1803 1574 A 46 ILE HA A 45 LYS HDy 1.0 . 4.41 1804 1575 A 46 ILE HB A 45 LYS HDx 1.0 . 4.80 1805 1575 A 46 ILE HB A 45 LYS HDy 1.0 . 4.80 1806 1576 A 46 ILE HD1% A 45 LYS HDx 1.0 . 3.67 1807 1576 A 46 ILE HD1% A 45 LYS HDy 1.0 . 3.67 1808 1577 A 47 ASN H A 45 LYS HDx 1.0 . 5.34 1809 1577 A 47 ASN H A 45 LYS HDy 1.0 . 5.34 1810 1578 A 46 ILE H A 46 ILE HG1x 1.0 . 3.29 1811 1578 A 46 ILE H A 46 ILE HG1y 1.0 . 3.29 1812 1579 A 46 ILE HA A 46 ILE HG1x 1.0 . 3.10 1813 1579 A 46 ILE HA A 46 ILE HG1y 1.0 . 3.10 1814 1580 A 46 ILE HG2% A 46 ILE HG1x 1.0 . 3.04 1815 1580 A 46 ILE HG2% A 46 ILE HG1y 1.0 . 3.04 1816 1581 A 49 TRP H A 60 LEU HDy% 1.0 . 5.44 1817 1581 A 49 TRP H A 60 LEU HDx% 1.0 . 5.44 1818 1582 A 49 TRP HBy A 60 LEU HDy% 1.0 . 4.45 1819 1582 A 49 TRP HBy A 60 LEU HDx% 1.0 . 4.45 1820 1583 A 49 TRP HBx A 60 LEU HDy% 1.0 . 4.43 1821 1583 A 49 TRP HBx A 60 LEU HDx% 1.0 . 4.43 1822 1584 A 50 THR HA A 87 VAL HGx% 1.0 . 5.44 1823 1584 A 50 THR HA A 87 VAL HGy% 1.0 . 5.44 1824 1585 A 50 THR HG2% A 146 ARG HBy 1.0 . 3.71 1825 1585 A 50 THR HG2% A 146 ARG HBx 1.0 . 3.71 1826 1586 A 50 THR HG2% A 146 ARG HDy 1.0 . 4.09 1827 1586 A 50 THR HG2% A 146 ARG HDx 1.0 . 4.09 1828 1587 A 51 ALA H A 146 ARG HDy 1.0 . 4.80 1829 1587 A 51 ALA H A 146 ARG HDx 1.0 . 4.80 1830 1588 A 51 ALA HA A 147 ILE HG1x 1.0 . 5.34 1831 1588 A 51 ALA HA A 147 ILE HG1y 1.0 . 5.34 1832 1589 A 51 ALA HB% A 54 ASN HBx 1.0 . 3.78 1833 1589 A 51 ALA HB% A 54 ASN HBy 1.0 . 3.78 1834 1590 A 52 GLN H A 52 GLN HBx 1.0 . 3.21 1835 1590 A 52 GLN H A 52 GLN HBy 1.0 . 3.21 1836 1591 A 52 GLN H A 52 GLN HGy 1.0 . 4.72 1837 1591 A 52 GLN H A 52 GLN HGx 1.0 . 4.72 1838 1592 A 53 SER H A 52 GLN HBx 1.0 . 3.51 1839 1592 A 53 SER H A 52 GLN HBy 1.0 . 3.51 1840 1593 A 53 SER H A 53 SER HBy 1.0 . 3.20 1841 1593 A 53 SER H A 53 SER HBx 1.0 . 3.20 1842 1594 A 54 ASN H A 53 SER HBy 1.0 . 3.83 1843 1594 A 54 ASN H A 53 SER HBx 1.0 . 3.83 1844 1595 A 54 ASN HD2x A 53 SER HBy 1.0 . 5.34 1845 1595 A 54 ASN HD2x A 53 SER HBx 1.0 . 5.34 1846 1596 A 55 SER H A 53 SER HBy 1.0 . 4.14 1847 1596 A 55 SER H A 53 SER HBx 1.0 . 4.14 1848 1597 A 54 ASN HA A 146 ARG HDy 1.0 . 4.83 1849 1597 A 54 ASN HA A 146 ARG HDx 1.0 . 4.83 1850 1598 A 54 ASN HD2y A 54 ASN HBx 1.0 . 3.60 1851 1598 A 54 ASN HD2y A 54 ASN HBy 1.0 . 3.60 1852 1599 A 54 ASN HBy A 146 ARG HDy 1.0 . 3.42 1853 1599 A 54 ASN HBx A 146 ARG HDy 1.0 . 3.42 1854 1599 A 146 ARG HDx A 54 ASN HBx 1.0 . 3.42 1855 1599 A 146 ARG HDx A 54 ASN HBy 1.0 . 3.42 1856 1600 A 146 ARG HE A 54 ASN HBx 1.0 . 4.10 1857 1600 A 146 ARG HE A 54 ASN HBy 1.0 . 4.10 1858 1601 A 147 ILE HD1% A 54 ASN HBx 1.0 . 3.82 1859 1601 A 147 ILE HD1% A 54 ASN HBy 1.0 . 3.82 1860 1602 A 55 SER H A 58 GLU HBy 1.0 . 4.39 1861 1602 A 55 SER H A 58 GLU HBx 1.0 . 4.39 1862 1603 A 55 SER H A 58 GLU HGy 1.0 . 5.34 1863 1603 A 55 SER H A 58 GLU HGx 1.0 . 5.34 1864 1604 A 55 SER H A 147 ILE HG1x 1.0 . 4.45 1865 1604 A 55 SER H A 147 ILE HG1y 1.0 . 4.45 1866 1605 A 55 SER HA A 55 SER HBx 1.0 . 2.60 1867 1605 A 55 SER HA A 55 SER HBy 1.0 . 2.60 1868 1606 A 56 ALA H A 55 SER HBx 1.0 . 3.77 1869 1606 A 56 ALA H A 55 SER HBy 1.0 . 3.77 1870 1607 A 57 LYS H A 55 SER HBx 1.0 . 3.82 1871 1607 A 57 LYS H A 55 SER HBy 1.0 . 3.82 1872 1608 A 55 SER HBx A 57 LYS HBx 1.0 . 3.89 1873 1608 A 55 SER HBy A 57 LYS HBx 1.0 . 3.89 1874 1608 A 57 LYS HBy A 55 SER HBx 1.0 . 3.89 1875 1608 A 55 SER HBy A 57 LYS HBy 1.0 . 3.89 1876 1609 A 55 SER HBy A 57 LYS HGx 1.0 . 4.36 1877 1609 A 55 SER HBx A 57 LYS HGx 1.0 . 4.36 1878 1609 A 57 LYS HGy A 55 SER HBx 1.0 . 4.36 1879 1609 A 55 SER HBy A 57 LYS HGy 1.0 . 4.36 1880 1610 A 55 SER HBx A 57 LYS HDy 1.0 . 3.99 1881 1610 A 55 SER HBy A 57 LYS HDy 1.0 . 3.99 1882 1610 A 57 LYS HDx A 55 SER HBx 1.0 . 3.99 1883 1610 A 55 SER HBy A 57 LYS HDx 1.0 . 3.99 1884 1611 A 58 GLU H A 55 SER HBx 1.0 . 4.13 1885 1611 A 58 GLU H A 55 SER HBy 1.0 . 4.13 1886 1612 A 56 ALA HA A 141 VAL HGx% 1.0 . 5.26 1887 1612 A 56 ALA HA A 141 VAL HGy% 1.0 . 5.26 1888 1613 A 56 ALA HB% A 141 VAL HGx% 1.0 . 3.47 1889 1613 A 56 ALA HB% A 141 VAL HGy% 1.0 . 3.47 1890 1614 A 57 LYS H A 57 LYS HBx 1.0 . 3.26 1891 1614 A 57 LYS H A 57 LYS HBy 1.0 . 3.26 1892 1615 A 57 LYS H A 57 LYS HGx 1.0 . 3.14 1893 1615 A 57 LYS H A 57 LYS HGy 1.0 . 3.14 1894 1616 A 57 LYS H A 57 LYS HDy 1.0 . 3.16 1895 1616 A 57 LYS H A 57 LYS HDx 1.0 . 3.16 1896 1617 A 57 LYS HA A 57 LYS HGx 1.0 . 3.59 1897 1617 A 57 LYS HA A 57 LYS HGy 1.0 . 3.59 1898 1618 A 57 LYS HA A 57 LYS HDy 1.0 . 4.76 1899 1618 A 57 LYS HA A 57 LYS HDx 1.0 . 4.76 1900 1619 A 57 LYS HBx A 57 LYS HDy 1.0 . 3.30 1901 1619 A 57 LYS HBy A 57 LYS HDy 1.0 . 3.30 1902 1619 A 57 LYS HDx A 57 LYS HBx 1.0 . 3.30 1903 1619 A 57 LYS HBy A 57 LYS HDx 1.0 . 3.30 1904 1620 A 58 GLU H A 57 LYS HBx 1.0 . 4.35 1905 1620 A 58 GLU H A 57 LYS HBy 1.0 . 4.35 1906 1621 A 58 GLU H A 57 LYS HGx 1.0 . 4.74 1907 1621 A 58 GLU H A 57 LYS HGy 1.0 . 4.74 1908 1622 A 58 GLU H A 58 GLU HBy 1.0 . 3.34 1909 1622 A 58 GLU H A 58 GLU HBx 1.0 . 3.34 1910 1623 A 58 GLU H A 147 ILE HG1x 1.0 . 5.34 1911 1623 A 58 GLU H A 147 ILE HG1y 1.0 . 5.34 1912 1624 A 59 TRP H A 58 GLU HGy 1.0 . 4.59 1913 1624 A 59 TRP H A 58 GLU HGx 1.0 . 4.59 1914 1625 A 59 TRP HA A 60 LEU HDy% 1.0 . 5.44 1915 1625 A 59 TRP HA A 60 LEU HDx% 1.0 . 5.44 1916 1626 A 59 TRP HA A 138 VAL HGx% 1.0 . 4.69 1917 1626 A 59 TRP HA A 138 VAL HGy% 1.0 . 4.69 1918 1627 A 59 TRP HA A 140 PRO HDx 1.0 . 5.19 1919 1627 A 59 TRP HA A 140 PRO HDy 1.0 . 5.19 1920 1628 A 59 TRP HBx A 140 PRO HDx 1.0 . 4.61 1921 1628 A 59 TRP HBx A 140 PRO HDy 1.0 . 4.61 1922 1629 A 60 LEU H A 60 LEU HDy% 1.0 . 4.28 1923 1629 A 60 LEU H A 60 LEU HDx% 1.0 . 4.28 1924 1630 A 60 LEU HA A 60 LEU HDy% 1.0 . 3.29 1925 1630 A 60 LEU HA A 60 LEU HDx% 1.0 . 3.29 1926 1631 A 61 GLN H A 60 LEU HDy% 1.0 . 3.63 1927 1631 A 61 GLN H A 60 LEU HDx% 1.0 . 3.63 1928 1632 A 138 VAL H A 60 LEU HDy% 1.0 . 5.44 1929 1632 A 138 VAL H A 60 LEU HDx% 1.0 . 5.44 1930 1633 A 61 GLN H A 61 GLN HGx 1.0 . 4.15 1931 1633 A 61 GLN H A 61 GLN HGy 1.0 . 4.15 1932 1634 A 61 GLN H A 61 GLN HE2y 1.0 . 4.31 1933 1634 A 61 GLN H A 61 GLN HE2x 1.0 . 4.31 1934 1635 A 61 GLN HA A 62 VAL HGx% 1.0 . 4.20 1935 1635 A 61 GLN HA A 62 VAL HGy% 1.0 . 4.20 1936 1636 A 61 GLN HA A 137 ARG HGx 1.0 . 4.84 1937 1636 A 61 GLN HA A 137 ARG HGy 1.0 . 4.84 1938 1637 A 137 ARG HA A 61 GLN HBx 1.0 . 5.19 1939 1637 A 137 ARG HA A 61 GLN HBy 1.0 . 5.19 1940 1638 A 61 GLN HBx A 137 ARG HBx 1.0 . 4.08 1941 1638 A 61 GLN HBy A 137 ARG HBx 1.0 . 4.08 1942 1638 A 137 ARG HBy A 61 GLN HBx 1.0 . 4.08 1943 1638 A 61 GLN HBy A 137 ARG HBy 1.0 . 4.08 1944 1639 A 138 VAL H A 61 GLN HBx 1.0 . 4.50 1945 1639 A 138 VAL H A 61 GLN HBy 1.0 . 4.50 1946 1640 A 62 VAL H A 62 VAL HGx% 1.0 . 3.19 1947 1640 A 62 VAL H A 62 VAL HGy% 1.0 . 3.19 1948 1641 A 63 ASP H A 62 VAL HGx% 1.0 . 3.27 1949 1641 A 63 ASP H A 62 VAL HGy% 1.0 . 3.27 1950 1642 A 64 LEU HG A 62 VAL HGx% 1.0 . 4.64 1951 1642 A 64 LEU HG A 62 VAL HGy% 1.0 . 4.64 1952 1643 A 62 VAL HGy% A 64 LEU HDy% 1.0 . 3.39 1953 1643 A 62 VAL HGx% A 64 LEU HDy% 1.0 . 3.39 1954 1643 A 64 LEU HDx% A 62 VAL HGx% 1.0 . 3.39 1955 1643 A 62 VAL HGy% A 64 LEU HDx% 1.0 . 3.39 1956 1644 A 135 TYR HA A 62 VAL HGx% 1.0 . 5.16 1957 1644 A 135 TYR HA A 62 VAL HGy% 1.0 . 5.16 1958 1645 A 136 VAL H A 62 VAL HGx% 1.0 . 3.65 1959 1645 A 136 VAL H A 62 VAL HGy% 1.0 . 3.65 1960 1646 A 136 VAL HGy% A 62 VAL HGx% 1.0 . 3.82 1961 1646 A 136 VAL HGy% A 62 VAL HGy% 1.0 . 3.82 1962 1647 A 63 ASP H A 63 ASP HBx 1.0 . 3.63 1963 1647 A 63 ASP H A 63 ASP HBy 1.0 . 3.63 1964 1648 A 64 LEU H A 64 LEU HDy% 1.0 . 3.54 1965 1648 A 64 LEU H A 64 LEU HDx% 1.0 . 3.54 1966 1649 A 64 LEU H A 65 GLY HAy 1.0 . 5.33 1967 1649 A 64 LEU H A 65 GLY HAx 1.0 . 5.33 1968 1650 A 64 LEU HA A 64 LEU HDy% 1.0 . 3.97 1969 1650 A 64 LEU HDx% A 64 LEU HA 1.0 . 3.97 1970 1651 A 65 GLY H A 64 LEU HBy 1.0 . 4.38 1971 1651 A 65 GLY H A 64 LEU HBx 1.0 . 4.38 1972 1652 A 66 THR H A 64 LEU HBy 1.0 . 3.80 1973 1652 A 66 THR H A 64 LEU HBx 1.0 . 3.80 1974 1653 A 65 GLY H A 64 LEU HDy% 1.0 . 4.53 1975 1653 A 65 GLY H A 64 LEU HDx% 1.0 . 4.53 1976 1654 A 67 GLN HA A 64 LEU HDy% 1.0 . 4.59 1977 1654 A 67 GLN HA A 64 LEU HDx% 1.0 . 4.59 1978 1655 A 68 ARG H A 64 LEU HDy% 1.0 . 3.95 1979 1655 A 68 ARG H A 64 LEU HDx% 1.0 . 3.95 1980 1656 A 136 VAL H A 64 LEU HDy% 1.0 . 4.33 1981 1656 A 136 VAL H A 64 LEU HDx% 1.0 . 4.33 1982 1657 A 136 VAL HA A 64 LEU HDy% 1.0 . 5.44 1983 1657 A 136 VAL HA A 64 LEU HDx% 1.0 . 5.44 1984 1658 A 65 GLY H A 135 TYR HBy 1.0 . 4.80 1985 1658 A 65 GLY H A 135 TYR HBx 1.0 . 4.80 1986 1659 A 66 THR H A 65 GLY HAy 1.0 . 3.01 1987 1659 A 66 THR H A 65 GLY HAx 1.0 . 3.01 1988 1660 A 66 THR HB A 65 GLY HAy 1.0 . 5.31 1989 1660 A 66 THR HB A 65 GLY HAx 1.0 . 5.31 1990 1661 A 134 ARG HA A 65 GLY HAy 1.0 . 5.12 1991 1661 A 134 ARG HA A 65 GLY HAx 1.0 . 5.12 1992 1662 A 134 ARG HE A 65 GLY HAy 1.0 . 4.43 1993 1662 A 134 ARG HE A 65 GLY HAx 1.0 . 4.43 1994 1663 A 66 THR HB A 68 ARG HGx 1.0 . 4.49 1995 1663 A 66 THR HB A 68 ARG HGy 1.0 . 4.49 1996 1664 A 66 THR HG2% A 68 ARG HBx 1.0 . 4.02 1997 1664 A 66 THR HG2% A 68 ARG HBy 1.0 . 4.02 1998 1665 A 66 THR HG2% A 68 ARG HGx 1.0 . 3.39 1999 1665 A 66 THR HG2% A 68 ARG HGy 1.0 . 3.39 2000 1666 A 66 THR HG2% A 68 ARG HDx 1.0 . 3.92 2001 1666 A 66 THR HG2% A 68 ARG HDy 1.0 . 3.92 2002 1667 A 67 GLN H A 67 GLN HBx 1.0 . 2.96 2003 1667 A 67 GLN H A 67 GLN HBy 1.0 . 2.96 2004 1668 A 67 GLN H A 67 GLN HGy 1.0 . 4.37 2005 1668 A 67 GLN H A 67 GLN HGx 1.0 . 4.37 2006 1669 A 67 GLN HA A 67 GLN HGy 1.0 . 3.38 2007 1669 A 67 GLN HA A 67 GLN HGx 1.0 . 3.38 2008 1670 A 68 ARG H A 67 GLN HBx 1.0 . 4.41 2009 1670 A 68 ARG H A 67 GLN HBy 1.0 . 4.41 2010 1671 A 132 MET HA A 67 GLN HGy 1.0 . 5.13 2011 1671 A 132 MET HA A 67 GLN HGx 1.0 . 5.13 2012 1672 A 133 ALA H A 67 GLN HGy 1.0 . 4.41 2013 1672 A 133 ALA H A 67 GLN HGx 1.0 . 4.41 2014 1673 A 133 ALA HA A 67 GLN HGy 1.0 . 4.42 2015 1673 A 133 ALA HA A 67 GLN HGx 1.0 . 4.42 2016 1674 A 68 ARG H A 68 ARG HBx 1.0 . 3.62 2017 1674 A 68 ARG H A 68 ARG HBy 1.0 . 3.62 2018 1675 A 68 ARG H A 68 ARG HDx 1.0 . 4.39 2019 1675 A 68 ARG H A 68 ARG HDy 1.0 . 4.39 2020 1676 A 68 ARG HA A 68 ARG HDx 1.0 . 3.19 2021 1676 A 68 ARG HA A 68 ARG HDy 1.0 . 3.19 2022 1677 A 68 ARG HA A 157 LEU HDy% 1.0 . 5.33 2023 1677 A 68 ARG HA A 157 LEU HDx% 1.0 . 5.33 2024 1678 A 69 GLN H A 68 ARG HBx 1.0 . 4.12 2025 1678 A 69 GLN H A 68 ARG HBy 1.0 . 4.12 2026 1679 A 68 ARG HE A 68 ARG HGx 1.0 . 3.34 2027 1679 A 68 ARG HE A 68 ARG HGy 1.0 . 3.34 2028 1680 A 68 ARG HGy A 157 LEU HDy% 1.0 . 3.87 2029 1680 A 68 ARG HGx A 157 LEU HDy% 1.0 . 3.87 2030 1680 A 157 LEU HDx% A 68 ARG HGx 1.0 . 3.87 2031 1680 A 157 LEU HDx% A 68 ARG HGy 1.0 . 3.87 2032 1681 A 69 GLN H A 68 ARG HDx 1.0 . 3.68 2033 1681 A 69 GLN H A 68 ARG HDy 1.0 . 3.68 2034 1682 A 157 LEU HA A 68 ARG HDx 1.0 . 3.84 2035 1682 A 157 LEU HA A 68 ARG HDy 1.0 . 3.84 2036 1683 A 68 ARG HDy A 157 LEU HBx 1.0 . 4.72 2037 1683 A 68 ARG HDx A 157 LEU HBx 1.0 . 4.72 2038 1683 A 157 LEU HBy A 68 ARG HDx 1.0 . 4.72 2039 1683 A 157 LEU HBy A 68 ARG HDy 1.0 . 4.72 2040 1684 A 68 ARG HDx A 157 LEU HDy% 1.0 . 3.08 2041 1684 A 157 LEU HDx% A 68 ARG HDx 1.0 . 3.08 2042 1684 A 157 LEU HDx% A 68 ARG HDy 1.0 . 3.08 2043 1684 A 68 ARG HDy A 157 LEU HDy% 1.0 . 3.08 2044 1685 A 68 ARG HE A 157 LEU HDy% 1.0 . 3.74 2045 1685 A 68 ARG HE A 157 LEU HDx% 1.0 . 3.74 2046 1686 A 69 GLN H A 157 LEU HDy% 1.0 . 5.13 2047 1686 A 69 GLN H A 157 LEU HDx% 1.0 . 5.13 2048 1687 A 70 VAL H A 69 GLN HGx 1.0 . 3.36 2049 1687 A 70 VAL H A 69 GLN HGy 1.0 . 3.36 2050 1688 A 131 PHE H A 69 GLN HGx 1.0 . 3.65 2051 1688 A 131 PHE H A 69 GLN HGy 1.0 . 3.65 2052 1689 A 156 CYS H A 69 GLN HGx 1.0 . 3.89 2053 1689 A 156 CYS H A 69 GLN HGy 1.0 . 3.89 2054 1690 A 70 VAL H A 131 PHE HBy 1.0 . 5.34 2055 1690 A 70 VAL H A 131 PHE HBx 1.0 . 5.34 2056 1691 A 71 THR H A 72 GLY HAx 1.0 . 4.36 2057 1691 A 71 THR H A 72 GLY HAy 1.0 . 4.36 2058 1692 A 71 THR HA A 72 GLY HAx 1.0 . 5.21 2059 1692 A 71 THR HA A 72 GLY HAy 1.0 . 5.21 2060 1693 A 71 THR HA A 127 PHE HBy 1.0 . 4.34 2061 1693 A 71 THR HA A 127 PHE HBx 1.0 . 4.34 2062 1694 A 71 THR HA A 130 PRO HDx 1.0 . 5.35 2063 1694 A 71 THR HA A 130 PRO HDy 1.0 . 5.35 2064 1695 A 71 THR HB A 72 GLY HAx 1.0 . 4.50 2065 1695 A 71 THR HB A 72 GLY HAy 1.0 . 4.50 2066 1696 A 71 THR HG2% A 72 GLY HAx 1.0 . 4.74 2067 1696 A 71 THR HG2% A 72 GLY HAy 1.0 . 4.74 2068 1697 A 71 THR HG2% A 127 PHE HBy 1.0 . 3.55 2069 1697 A 71 THR HG2% A 127 PHE HBx 1.0 . 3.55 2070 1698 A 71 THR HG2% A 130 PRO HDx 1.0 . 5.27 2071 1698 A 71 THR HG2% A 130 PRO HDy 1.0 . 5.27 2072 1699 A 71 THR HG2% A 156 CYS HBx 1.0 . 3.47 2073 1699 A 71 THR HG2% A 156 CYS HBy 1.0 . 3.47 2074 1700 A 72 GLY H A 154 LEU HDy% 1.0 . 4.34 2075 1700 A 72 GLY H A 154 LEU HDx% 1.0 . 4.34 2076 1701 A 73 ILE HG2% A 72 GLY HAx 1.0 . 3.87 2077 1701 A 73 ILE HG2% A 72 GLY HAy 1.0 . 3.87 2078 1702 A 73 ILE HD1% A 72 GLY HAx 1.0 . 5.34 2079 1702 A 73 ILE HD1% A 72 GLY HAy 1.0 . 5.34 2080 1703 A 72 GLY HAx A 125 ASN HBx 1.0 . 5.18 2081 1703 A 72 GLY HAy A 125 ASN HBx 1.0 . 5.18 2082 1703 A 125 ASN HBy A 72 GLY HAx 1.0 . 5.18 2083 1703 A 72 GLY HAy A 125 ASN HBy 1.0 . 5.18 2084 1704 A 126 ILE HA A 72 GLY HAx 1.0 . 4.21 2085 1704 A 126 ILE HA A 72 GLY HAy 1.0 . 4.21 2086 1705 A 127 PHE H A 72 GLY HAx 1.0 . 4.24 2087 1705 A 127 PHE H A 72 GLY HAy 1.0 . 4.24 2088 1706 A 127 PHE HD% A 72 GLY HAx 1.0 . 5.34 2089 1706 A 127 PHE HD% A 72 GLY HAy 1.0 . 5.34 2090 1707 A 128 GLU H A 72 GLY HAx 1.0 . 5.34 2091 1707 A 128 GLU H A 72 GLY HAy 1.0 . 5.34 2092 1708 A 154 LEU HBy A 72 GLY HAx 1.0 . 4.50 2093 1708 A 154 LEU HBy A 72 GLY HAy 1.0 . 4.50 2094 1709 A 73 ILE HG2% A 125 ASN HBx 1.0 . 4.81 2095 1709 A 73 ILE HG2% A 125 ASN HBy 1.0 . 4.81 2096 1710 A 73 ILE HD1% A 125 ASN HBx 1.0 . 4.35 2097 1710 A 73 ILE HD1% A 125 ASN HBy 1.0 . 4.35 2098 1711 A 74 ILE HA A 124 LYS HBy 1.0 . 4.69 2099 1711 A 74 ILE HA A 124 LYS HBx 1.0 . 4.69 2100 1712 A 75 THR H A 74 ILE HG1y 1.0 . 4.87 2101 1712 A 75 THR H A 74 ILE HG1x 1.0 . 4.87 2102 1713 A 123 LYS H A 74 ILE HG1y 1.0 . 5.27 2103 1713 A 123 LYS H A 74 ILE HG1x 1.0 . 5.27 2104 1714 A 74 ILE HD1% A 122 HIS HBx 1.0 . 3.66 2105 1714 A 74 ILE HD1% A 122 HIS HBy 1.0 . 3.66 2106 1715 A 75 THR H A 124 LYS HBy 1.0 . 4.78 2107 1715 A 75 THR H A 124 LYS HBx 1.0 . 4.78 2108 1716 A 75 THR HA A 76 GLN HGx 1.0 . 5.21 2109 1716 A 75 THR HA A 76 GLN HGy 1.0 . 5.21 2110 1717 A 76 GLN H A 76 GLN HGx 1.0 . 4.27 2111 1717 A 76 GLN H A 76 GLN HGy 1.0 . 4.27 2112 1718 A 76 GLN H A 149 LEU HBy 1.0 . 4.73 2113 1718 A 76 GLN H A 149 LEU HBx 1.0 . 4.73 2114 1719 A 76 GLN H A 149 LEU HDy% 1.0 . 4.83 2115 1719 A 76 GLN H A 149 LEU HDx% 1.0 . 4.83 2116 1720 A 76 GLN HA A 76 GLN HGx 1.0 . 3.52 2117 1720 A 76 GLN HA A 76 GLN HGy 1.0 . 3.52 2118 1721 A 76 GLN HA A 76 GLN HE2y 1.0 . 4.08 2119 1721 A 76 GLN HA A 76 GLN HE2x 1.0 . 4.08 2120 1722 A 77 GLY H A 76 GLN HBy 1.0 . 4.37 2121 1722 A 77 GLY H A 76 GLN HBx 1.0 . 4.37 2122 1723 A 76 GLN HE2x A 76 GLN HGx 1.0 . 3.11 2123 1723 A 76 GLN HE2y A 76 GLN HGx 1.0 . 3.11 2124 1723 A 76 GLN HGy A 76 GLN HE2y 1.0 . 3.11 2125 1723 A 76 GLN HGy A 76 GLN HE2x 1.0 . 3.11 2126 1724 A 77 GLY H A 76 GLN HGx 1.0 . 4.08 2127 1724 A 77 GLY H A 76 GLN HGy 1.0 . 4.08 2128 1725 A 86 TYR HA A 77 GLY HAx 1.0 . 3.92 2129 1725 A 86 TYR HA A 77 GLY HAy 1.0 . 3.92 2130 1726 A 77 GLY HAy A 86 TYR HBy 1.0 . 3.71 2131 1726 A 77 GLY HAx A 86 TYR HBy 1.0 . 3.71 2132 1726 A 86 TYR HBx A 77 GLY HAx 1.0 . 3.71 2133 1726 A 77 GLY HAy A 86 TYR HBx 1.0 . 3.71 2134 1727 A 87 VAL H A 77 GLY HAx 1.0 . 4.82 2135 1727 A 87 VAL H A 77 GLY HAy 1.0 . 4.82 2136 1728 A 119 ASN HA A 77 GLY HAx 1.0 . 4.08 2137 1728 A 119 ASN HA A 77 GLY HAy 1.0 . 4.08 2138 1729 A 148 THR HB A 77 GLY HAx 1.0 . 4.95 2139 1729 A 148 THR HB A 77 GLY HAy 1.0 . 4.95 2140 1730 A 78 ALA H A 85 GLN HBx 1.0 . 4.68 2141 1730 A 78 ALA H A 85 GLN HBy 1.0 . 4.68 2142 1731 A 78 ALA H A 86 TYR HBy 1.0 . 4.45 2143 1731 A 78 ALA H A 86 TYR HBx 1.0 . 4.45 2144 1732 A 78 ALA H A 119 ASN HBy 1.0 . 3.94 2145 1732 A 78 ALA H A 119 ASN HBx 1.0 . 3.94 2146 1733 A 78 ALA HA A 79 ARG HBx 1.0 . 4.71 2147 1733 A 78 ALA HA A 79 ARG HBy 1.0 . 4.71 2148 1734 A 78 ALA HA A 119 ASN HBy 1.0 . 3.61 2149 1734 A 78 ALA HA A 119 ASN HBx 1.0 . 3.61 2150 1735 A 78 ALA HB% A 119 ASN HBy 1.0 . 4.64 2151 1735 A 78 ALA HB% A 119 ASN HBx 1.0 . 4.64 2152 1736 A 79 ARG H A 79 ARG HBx 1.0 . 3.35 2153 1736 A 79 ARG H A 79 ARG HBy 1.0 . 3.35 2154 1737 A 79 ARG H A 79 ARG HGx 1.0 . 3.82 2155 1737 A 79 ARG H A 79 ARG HGy 1.0 . 3.82 2156 1738 A 79 ARG H A 79 ARG HDy 1.0 . 4.15 2157 1738 A 79 ARG H A 79 ARG HDx 1.0 . 4.15 2158 1739 A 79 ARG H A 85 GLN HBx 1.0 . 5.34 2159 1739 A 79 ARG H A 85 GLN HBy 1.0 . 5.34 2160 1740 A 79 ARG H A 119 ASN HBy 1.0 . 4.21 2161 1740 A 79 ARG H A 119 ASN HBx 1.0 . 4.21 2162 1741 A 79 ARG HA A 79 ARG HGx 1.0 . 3.54 2163 1741 A 79 ARG HA A 79 ARG HGy 1.0 . 3.54 2164 1742 A 79 ARG HA A 79 ARG HDy 1.0 . 4.78 2165 1742 A 79 ARG HA A 79 ARG HDx 1.0 . 4.78 2166 1743 A 79 ARG HA A 80 ASP HBx 1.0 . 4.98 2167 1743 A 79 ARG HA A 80 ASP HBy 1.0 . 4.98 2168 1744 A 79 ARG HA A 85 GLN HBx 1.0 . 4.50 2169 1744 A 79 ARG HA A 85 GLN HBy 1.0 . 4.50 2170 1745 A 79 ARG HA A 85 GLN HGx 1.0 . 5.05 2171 1745 A 79 ARG HA A 85 GLN HGy 1.0 . 5.05 2172 1746 A 79 ARG HA A 119 ASN HBy 1.0 . 5.34 2173 1746 A 79 ARG HA A 119 ASN HBx 1.0 . 5.34 2174 1747 A 79 ARG HBy A 79 ARG HDy 1.0 . 3.16 2175 1747 A 79 ARG HBx A 79 ARG HDy 1.0 . 3.16 2176 1747 A 79 ARG HDx A 79 ARG HBx 1.0 . 3.16 2177 1747 A 79 ARG HBy A 79 ARG HDx 1.0 . 3.16 2178 1748 A 81 PHE H A 79 ARG HBx 1.0 . 4.85 2179 1748 A 81 PHE H A 79 ARG HBy 1.0 . 4.85 2180 1749 A 84 ILE HA A 79 ARG HBx 1.0 . 3.98 2181 1749 A 84 ILE HA A 79 ARG HBy 1.0 . 3.98 2182 1750 A 84 ILE HG2% A 79 ARG HBx 1.0 . 5.06 2183 1750 A 84 ILE HG2% A 79 ARG HBy 1.0 . 5.06 2184 1751 A 84 ILE HD1% A 79 ARG HBx 1.0 . 5.34 2185 1751 A 84 ILE HD1% A 79 ARG HBy 1.0 . 5.34 2186 1752 A 85 GLN H A 79 ARG HBx 1.0 . 4.82 2187 1752 A 85 GLN H A 79 ARG HBy 1.0 . 4.82 2188 1753 A 79 ARG HBy A 119 ASN HBy 1.0 . 4.76 2189 1753 A 79 ARG HBx A 119 ASN HBy 1.0 . 4.76 2190 1753 A 119 ASN HBx A 79 ARG HBx 1.0 . 4.76 2191 1753 A 119 ASN HBx A 79 ARG HBy 1.0 . 4.76 2192 1754 A 81 PHE H A 79 ARG HGx 1.0 . 4.89 2193 1754 A 81 PHE H A 79 ARG HGy 1.0 . 4.89 2194 1755 A 81 PHE HA A 79 ARG HGx 1.0 . 5.33 2195 1755 A 81 PHE HA A 79 ARG HGy 1.0 . 5.33 2196 1756 A 82 GLY H A 79 ARG HGx 1.0 . 4.97 2197 1756 A 82 GLY H A 79 ARG HGy 1.0 . 4.97 2198 1757 A 84 ILE HA A 79 ARG HGx 1.0 . 4.70 2199 1757 A 84 ILE HA A 79 ARG HGy 1.0 . 4.70 2200 1758 A 81 PHE HA A 79 ARG HDy 1.0 . 5.16 2201 1758 A 81 PHE HA A 79 ARG HDx 1.0 . 5.16 2202 1759 A 82 GLY H A 79 ARG HDy 1.0 . 4.68 2203 1759 A 82 GLY H A 79 ARG HDx 1.0 . 4.68 2204 1760 A 79 ARG HDy A 82 GLY HAy 1.0 . 5.18 2205 1760 A 82 GLY HAx A 79 ARG HDy 1.0 . 5.18 2206 1760 A 79 ARG HDx A 82 GLY HAx 1.0 . 5.18 2207 1760 A 79 ARG HDx A 82 GLY HAy 1.0 . 5.18 2208 1761 A 80 ASP H A 83 HIS HBx 1.0 . 4.16 2209 1761 A 80 ASP H A 83 HIS HBy 1.0 . 4.16 2210 1762 A 80 ASP H A 85 GLN HGx 1.0 . 4.62 2211 1762 A 80 ASP H A 85 GLN HGy 1.0 . 4.62 2212 1763 A 80 ASP HA A 81 PHE HBy 1.0 . 4.87 2213 1763 A 80 ASP HA A 81 PHE HBx 1.0 . 4.87 2214 1764 A 81 PHE H A 80 ASP HBx 1.0 . 4.22 2215 1764 A 81 PHE H A 80 ASP HBy 1.0 . 4.22 2216 1765 A 81 PHE HD% A 80 ASP HBx 1.0 . 4.29 2217 1765 A 81 PHE HD% A 80 ASP HBy 1.0 . 4.29 2218 1766 A 82 GLY H A 83 HIS HBx 1.0 . 5.15 2219 1766 A 82 GLY H A 83 HIS HBy 1.0 . 5.15 2220 1767 A 83 HIS HA A 82 GLY HAy 1.0 . 5.33 2221 1767 A 83 HIS HA A 82 GLY HAx 1.0 . 5.33 2222 1768 A 84 ILE HA A 119 ASN HBy 1.0 . 4.41 2223 1768 A 84 ILE HA A 119 ASN HBx 1.0 . 4.41 2224 1769 A 85 GLN H A 85 GLN HGx 1.0 . 4.48 2225 1769 A 85 GLN H A 85 GLN HGy 1.0 . 4.48 2226 1770 A 85 GLN HA A 86 TYR HBy 1.0 . 5.34 2227 1770 A 85 GLN HA A 86 TYR HBx 1.0 . 5.34 2228 1771 A 85 GLN HA A 144 HIS HBy 1.0 . 4.39 2229 1771 A 85 GLN HA A 144 HIS HBx 1.0 . 4.39 2230 1772 A 85 GLN HA A 145 ASN HBy 1.0 . 4.15 2231 1772 A 85 GLN HA A 145 ASN HBx 1.0 . 4.15 2232 1773 A 86 TYR H A 85 GLN HBx 1.0 . 3.44 2233 1773 A 86 TYR H A 85 GLN HBy 1.0 . 3.44 2234 1774 A 148 THR H A 85 GLN HBx 1.0 . 4.81 2235 1774 A 148 THR H A 85 GLN HBy 1.0 . 4.81 2236 1775 A 148 THR HB A 85 GLN HBx 1.0 . 3.71 2237 1775 A 148 THR HB A 85 GLN HBy 1.0 . 3.71 2238 1776 A 148 THR HG2% A 85 GLN HBx 1.0 . 3.79 2239 1776 A 148 THR HG2% A 85 GLN HBy 1.0 . 3.79 2240 1777 A 86 TYR H A 85 GLN HGx 1.0 . 4.80 2241 1777 A 86 TYR H A 85 GLN HGy 1.0 . 4.80 2242 1778 A 146 ARG H A 85 GLN HGx 1.0 . 3.99 2243 1778 A 146 ARG H A 85 GLN HGy 1.0 . 3.99 2244 1779 A 86 TYR H A 86 TYR HBy 1.0 . 3.68 2245 1779 A 86 TYR H A 86 TYR HBx 1.0 . 3.68 2246 1780 A 86 TYR H A 144 HIS HBy 1.0 . 4.72 2247 1780 A 86 TYR H A 144 HIS HBx 1.0 . 4.72 2248 1781 A 86 TYR HA A 87 VAL HGx% 1.0 . 3.90 2249 1781 A 86 TYR HA A 87 VAL HGy% 1.0 . 3.90 2250 1782 A 86 TYR HA A 149 LEU HBy 1.0 . 5.04 2251 1782 A 86 TYR HA A 149 LEU HBx 1.0 . 5.04 2252 1783 A 87 VAL H A 86 TYR HBy 1.0 . 3.93 2253 1783 A 87 VAL H A 86 TYR HBx 1.0 . 3.93 2254 1784 A 87 VAL H A 87 VAL HGx% 1.0 . 3.55 2255 1784 A 87 VAL H A 87 VAL HGy% 1.0 . 3.55 2256 1785 A 87 VAL H A 149 LEU HBy 1.0 . 4.88 2257 1785 A 87 VAL H A 149 LEU HBx 1.0 . 4.88 2258 1786 A 87 VAL HA A 143 TRP HBy 1.0 . 4.22 2259 1786 A 87 VAL HA A 143 TRP HBx 1.0 . 4.22 2260 1787 A 87 VAL HB A 149 LEU HDy% 1.0 . 4.81 2261 1787 A 87 VAL HB A 149 LEU HDx% 1.0 . 4.81 2262 1788 A 89 SER H A 87 VAL HGx% 1.0 . 4.38 2263 1788 A 89 SER H A 87 VAL HGy% 1.0 . 4.38 2264 1789 A 90 TYR H A 87 VAL HGx% 1.0 . 5.09 2265 1789 A 90 TYR H A 87 VAL HGy% 1.0 . 5.09 2266 1790 A 90 TYR HA A 87 VAL HGx% 1.0 . 4.18 2267 1790 A 90 TYR HA A 87 VAL HGy% 1.0 . 4.18 2268 1791 A 87 VAL HGx% A 90 TYR HBx 1.0 . 3.46 2269 1791 A 87 VAL HGy% A 90 TYR HBx 1.0 . 3.46 2270 1791 A 90 TYR HBy A 87 VAL HGx% 1.0 . 3.46 2271 1791 A 87 VAL HGy% A 90 TYR HBy 1.0 . 3.46 2272 1792 A 140 PRO HA A 87 VAL HGx% 1.0 . 3.81 2273 1792 A 140 PRO HA A 87 VAL HGy% 1.0 . 3.81 2274 1793 A 87 VAL HGy% A 140 PRO HBy 1.0 . 3.48 2275 1793 A 87 VAL HGx% A 140 PRO HBy 1.0 . 3.48 2276 1793 A 140 PRO HBx A 87 VAL HGx% 1.0 . 3.48 2277 1793 A 87 VAL HGy% A 140 PRO HBx 1.0 . 3.48 2278 1794 A 87 VAL HGy% A 140 PRO HDx 1.0 . 4.86 2279 1794 A 87 VAL HGx% A 140 PRO HDx 1.0 . 4.86 2280 1794 A 140 PRO HDy A 87 VAL HGx% 1.0 . 4.86 2281 1794 A 87 VAL HGy% A 140 PRO HDy 1.0 . 4.86 2282 1795 A 141 VAL H A 87 VAL HGx% 1.0 . 4.21 2283 1795 A 141 VAL H A 87 VAL HGy% 1.0 . 4.21 2284 1796 A 142 SER H A 87 VAL HGx% 1.0 . 4.33 2285 1796 A 142 SER H A 87 VAL HGy% 1.0 . 4.33 2286 1797 A 143 TRP H A 87 VAL HGx% 1.0 . 5.44 2287 1797 A 143 TRP H A 87 VAL HGy% 1.0 . 5.44 2288 1798 A 87 VAL HGy% A 143 TRP HBy 1.0 . 4.52 2289 1798 A 143 TRP HBx A 87 VAL HGx% 1.0 . 4.52 2290 1798 A 87 VAL HGy% A 143 TRP HBx 1.0 . 4.52 2291 1798 A 87 VAL HGx% A 143 TRP HBy 1.0 . 4.52 2292 1799 A 147 ILE H A 87 VAL HGx% 1.0 . 4.62 2293 1799 A 147 ILE H A 87 VAL HGy% 1.0 . 4.62 2294 1800 A 147 ILE HA A 87 VAL HGx% 1.0 . 3.41 2295 1800 A 147 ILE HA A 87 VAL HGy% 1.0 . 3.41 2296 1801 A 147 ILE HG2% A 87 VAL HGx% 1.0 . 3.03 2297 1801 A 147 ILE HG2% A 87 VAL HGy% 1.0 . 3.03 2298 1802 A 87 VAL HGx% A 147 ILE HG1x 1.0 . 4.46 2299 1802 A 87 VAL HGy% A 147 ILE HG1x 1.0 . 4.46 2300 1802 A 147 ILE HG1y A 87 VAL HGx% 1.0 . 4.46 2301 1802 A 87 VAL HGy% A 147 ILE HG1y 1.0 . 4.46 2302 1803 A 147 ILE HD1% A 87 VAL HGx% 1.0 . 4.31 2303 1803 A 147 ILE HD1% A 87 VAL HGy% 1.0 . 4.31 2304 1804 A 148 THR H A 87 VAL HGx% 1.0 . 3.33 2305 1804 A 148 THR H A 87 VAL HGy% 1.0 . 3.33 2306 1805 A 148 THR HA A 87 VAL HGx% 1.0 . 4.77 2307 1805 A 148 THR HA A 87 VAL HGy% 1.0 . 4.77 2308 1806 A 148 THR HB A 87 VAL HGx% 1.0 . 5.05 2309 1806 A 148 THR HB A 87 VAL HGy% 1.0 . 5.05 2310 1807 A 149 LEU H A 87 VAL HGx% 1.0 . 4.48 2311 1807 A 149 LEU H A 87 VAL HGy% 1.0 . 4.48 2312 1808 A 87 VAL HGx% A 149 LEU HBy 1.0 . 3.26 2313 1808 A 87 VAL HGy% A 149 LEU HBy 1.0 . 3.26 2314 1808 A 149 LEU HBx A 87 VAL HGx% 1.0 . 3.26 2315 1808 A 87 VAL HGy% A 149 LEU HBx 1.0 . 3.26 2316 1809 A 87 VAL HGx% A 149 LEU HDy% 1.0 . 3.25 2317 1809 A 87 VAL HGy% A 149 LEU HDy% 1.0 . 3.25 2318 1809 A 149 LEU HDx% A 87 VAL HGx% 1.0 . 3.25 2319 1809 A 87 VAL HGy% A 149 LEU HDx% 1.0 . 3.25 2320 1810 A 88 ALA H A 143 TRP HBy 1.0 . 4.27 2321 1810 A 88 ALA H A 143 TRP HBx 1.0 . 4.27 2322 1811 A 88 ALA HA A 115 GLY HAy 1.0 . 4.50 2323 1811 A 88 ALA HA A 115 GLY HAx 1.0 . 4.50 2324 1812 A 88 ALA HB% A 115 GLY HAy 1.0 . 4.19 2325 1812 A 88 ALA HB% A 115 GLY HAx 1.0 . 4.19 2326 1813 A 88 ALA HB% A 143 TRP HBy 1.0 . 5.34 2327 1813 A 88 ALA HB% A 143 TRP HBx 1.0 . 5.34 2328 1814 A 89 SER H A 90 TYR HBx 1.0 . 5.03 2329 1814 A 89 SER H A 90 TYR HBy 1.0 . 5.03 2330 1815 A 89 SER H A 112 VAL HGx% 1.0 . 5.13 2331 1815 A 89 SER H A 112 VAL HGy% 1.0 . 5.13 2332 1816 A 89 SER H A 141 VAL HGx% 1.0 . 5.44 2333 1816 A 89 SER H A 141 VAL HGy% 1.0 . 5.44 2334 1817 A 90 TYR H A 89 SER HBx 1.0 . 3.87 2335 1817 A 90 TYR H A 89 SER HBy 1.0 . 3.87 2336 1818 A 89 SER HBx A 112 VAL HGx% 1.0 . 3.23 2337 1818 A 89 SER HBy A 112 VAL HGx% 1.0 . 3.23 2338 1818 A 112 VAL HGy% A 89 SER HBx 1.0 . 3.23 2339 1818 A 112 VAL HGy% A 89 SER HBy 1.0 . 3.23 2340 1819 A 114 GLN HA A 89 SER HBx 1.0 . 4.87 2341 1819 A 114 GLN HA A 89 SER HBy 1.0 . 4.87 2342 1820 A 142 SER H A 89 SER HBx 1.0 . 4.39 2343 1820 A 142 SER H A 89 SER HBy 1.0 . 4.39 2344 1821 A 90 TYR H A 112 VAL HGx% 1.0 . 3.68 2345 1821 A 90 TYR H A 112 VAL HGy% 1.0 . 3.68 2346 1822 A 90 TYR HA A 141 VAL HGx% 1.0 . 3.19 2347 1822 A 90 TYR HA A 141 VAL HGy% 1.0 . 3.19 2348 1823 A 91 LYS H A 90 TYR HBx 1.0 . 3.61 2349 1823 A 91 LYS H A 90 TYR HBy 1.0 . 3.61 2350 1824 A 90 TYR HBy A 138 VAL HGx% 1.0 . 4.33 2351 1824 A 90 TYR HBx A 138 VAL HGx% 1.0 . 4.33 2352 1824 A 138 VAL HGy% A 90 TYR HBx 1.0 . 4.33 2353 1824 A 138 VAL HGy% A 90 TYR HBy 1.0 . 4.33 2354 1825 A 139 LEU H A 90 TYR HBx 1.0 . 4.93 2355 1825 A 139 LEU H A 90 TYR HBy 1.0 . 4.93 2356 1826 A 140 PRO HA A 90 TYR HBx 1.0 . 4.55 2357 1826 A 140 PRO HA A 90 TYR HBy 1.0 . 4.55 2358 1827 A 142 SER H A 90 TYR HBx 1.0 . 5.34 2359 1827 A 142 SER H A 90 TYR HBy 1.0 . 5.34 2360 1828 A 91 LYS H A 91 LYS HBy 1.0 . 3.55 2361 1828 A 91 LYS H A 91 LYS HBx 1.0 . 3.55 2362 1829 A 91 LYS H A 112 VAL HGx% 1.0 . 4.20 2363 1829 A 91 LYS H A 112 VAL HGy% 1.0 . 4.20 2364 1830 A 91 LYS H A 138 VAL HGx% 1.0 . 3.93 2365 1830 A 91 LYS H A 138 VAL HGy% 1.0 . 3.93 2366 1831 A 91 LYS H A 141 VAL HGx% 1.0 . 3.84 2367 1831 A 91 LYS H A 141 VAL HGy% 1.0 . 3.84 2368 1832 A 91 LYS HA A 112 VAL HGx% 1.0 . 4.15 2369 1832 A 91 LYS HA A 112 VAL HGy% 1.0 . 4.15 2370 1833 A 91 LYS HA A 113 PHE HBy 1.0 . 4.72 2371 1833 A 91 LYS HA A 113 PHE HBx 1.0 . 4.72 2372 1834 A 139 LEU H A 91 LYS HBy 1.0 . 4.37 2373 1834 A 139 LEU H A 91 LYS HBx 1.0 . 4.37 2374 1835 A 92 VAL H A 91 LYS HGx 1.0 . 4.22 2375 1835 A 92 VAL H A 91 LYS HGy 1.0 . 4.22 2376 1836 A 112 VAL H A 91 LYS HGx 1.0 . 4.46 2377 1836 A 112 VAL H A 91 LYS HGy 1.0 . 4.46 2378 1837 A 91 LYS HGx A 112 VAL HGx% 1.0 . 4.71 2379 1837 A 91 LYS HGy A 112 VAL HGx% 1.0 . 4.71 2380 1837 A 112 VAL HGy% A 91 LYS HGx 1.0 . 4.71 2381 1837 A 112 VAL HGy% A 91 LYS HGy 1.0 . 4.71 2382 1838 A 92 VAL H A 91 LYS HDy 1.0 . 4.29 2383 1838 A 92 VAL H A 91 LYS HDx 1.0 . 4.29 2384 1839 A 111 LYS H A 91 LYS HEx 1.0 . 5.23 2385 1839 A 111 LYS H A 91 LYS HEy 1.0 . 5.23 2386 1840 A 112 VAL H A 91 LYS HEx 1.0 . 4.75 2387 1840 A 112 VAL H A 91 LYS HEy 1.0 . 4.75 2388 1841 A 92 VAL H A 92 VAL HGx% 1.0 . 3.47 2389 1841 A 92 VAL H A 92 VAL HGy% 1.0 . 3.47 2390 1842 A 92 VAL H A 138 VAL HGx% 1.0 . 4.79 2391 1842 A 92 VAL H A 138 VAL HGy% 1.0 . 4.79 2392 1843 A 92 VAL HA A 138 VAL HGx% 1.0 . 4.18 2393 1843 A 92 VAL HA A 138 VAL HGy% 1.0 . 4.18 2394 1844 A 93 ALA H A 92 VAL HGx% 1.0 . 3.18 2395 1844 A 93 ALA H A 92 VAL HGy% 1.0 . 3.18 2396 1845 A 93 ALA HA A 92 VAL HGx% 1.0 . 3.90 2397 1845 A 93 ALA HA A 92 VAL HGy% 1.0 . 3.90 2398 1846 A 94 HIS HA A 92 VAL HGx% 1.0 . 5.19 2399 1846 A 94 HIS HA A 92 VAL HGy% 1.0 . 5.19 2400 1847 A 94 HIS HD2 A 92 VAL HGx% 1.0 . 3.89 2401 1847 A 94 HIS HD2 A 92 VAL HGy% 1.0 . 3.89 2402 1848 A 104 TYR HD% A 92 VAL HGx% 1.0 . 3.82 2403 1848 A 104 TYR HD% A 92 VAL HGy% 1.0 . 3.82 2404 1849 A 113 PHE H A 92 VAL HGx% 1.0 . 4.80 2405 1849 A 113 PHE H A 92 VAL HGy% 1.0 . 4.80 2406 1850 A 113 PHE HD% A 92 VAL HGx% 1.0 . 4.67 2407 1850 A 113 PHE HD% A 92 VAL HGy% 1.0 . 4.67 2408 1851 A 92 VAL HGy% A 138 VAL HGx% 1.0 . 3.05 2409 1851 A 92 VAL HGx% A 138 VAL HGx% 1.0 . 3.05 2410 1851 A 138 VAL HGy% A 92 VAL HGx% 1.0 . 3.05 2411 1851 A 138 VAL HGy% A 92 VAL HGy% 1.0 . 3.05 2412 1852 A 93 ALA H A 138 VAL HGx% 1.0 . 3.60 2413 1852 A 93 ALA H A 138 VAL HGy% 1.0 . 3.60 2414 1853 A 93 ALA HA A 138 VAL HGx% 1.0 . 5.44 2415 1853 A 93 ALA HA A 138 VAL HGy% 1.0 . 5.44 2416 1854 A 93 ALA HB% A 103 VAL HGx% 1.0 . 2.92 2417 1854 A 93 ALA HB% A 103 VAL HGy% 1.0 . 2.92 2418 1855 A 94 HIS H A 94 HIS HBx 1.0 . 3.54 2419 1855 A 94 HIS H A 94 HIS HBy 1.0 . 3.54 2420 1856 A 94 HIS HA A 138 VAL HGx% 1.0 . 5.44 2421 1856 A 94 HIS HA A 138 VAL HGy% 1.0 . 5.44 2422 1857 A 95 SER H A 94 HIS HBx 1.0 . 3.58 2423 1857 A 95 SER H A 94 HIS HBy 1.0 . 3.58 2424 1858 A 133 ALA HB% A 94 HIS HBx 1.0 . 3.58 2425 1858 A 133 ALA HB% A 94 HIS HBy 1.0 . 3.58 2426 1859 A 136 VAL HA A 94 HIS HBx 1.0 . 4.73 2427 1859 A 136 VAL HA A 94 HIS HBy 1.0 . 4.73 2428 1860 A 136 VAL HB A 94 HIS HBx 1.0 . 5.34 2429 1860 A 136 VAL HB A 94 HIS HBy 1.0 . 5.34 2430 1861 A 136 VAL HGx% A 94 HIS HBx 1.0 . 4.63 2431 1861 A 136 VAL HGx% A 94 HIS HBy 1.0 . 4.63 2432 1862 A 137 ARG H A 94 HIS HBx 1.0 . 5.34 2433 1862 A 137 ARG H A 94 HIS HBy 1.0 . 5.34 2434 1863 A 94 HIS HD2 A 138 VAL HGx% 1.0 . 5.20 2435 1863 A 94 HIS HD2 A 138 VAL HGy% 1.0 . 5.20 2436 1864 A 95 SER H A 135 TYR HBy 1.0 . 5.12 2437 1864 A 95 SER H A 135 TYR HBx 1.0 . 5.12 2438 1865 A 96 ASP H A 97 ASP HBy 1.0 . 5.20 2439 1865 A 96 ASP H A 97 ASP HBx 1.0 . 5.20 2440 1866 A 97 ASP H A 96 ASP HBy 1.0 . 3.96 2441 1866 A 97 ASP H A 96 ASP HBx 1.0 . 3.96 2442 1867 A 98 GLY H A 96 ASP HBy 1.0 . 5.27 2443 1867 A 98 GLY H A 96 ASP HBx 1.0 . 5.27 2444 1868 A 133 ALA HB% A 96 ASP HBy 1.0 . 4.72 2445 1868 A 133 ALA HB% A 96 ASP HBx 1.0 . 4.72 2446 1869 A 97 ASP H A 97 ASP HBy 1.0 . 3.65 2447 1869 A 97 ASP H A 97 ASP HBx 1.0 . 3.65 2448 1870 A 97 ASP HBy A 99 VAL HGx% 1.0 . 4.00 2449 1870 A 97 ASP HBx A 99 VAL HGx% 1.0 . 4.00 2450 1870 A 99 VAL HGy% A 97 ASP HBy 1.0 . 4.00 2451 1870 A 97 ASP HBx A 99 VAL HGy% 1.0 . 4.00 2452 1871 A 100 GLN H A 97 ASP HBy 1.0 . 3.83 2453 1871 A 100 GLN H A 97 ASP HBx 1.0 . 3.83 2454 1872 A 98 GLY H A 99 VAL HGx% 1.0 . 4.27 2455 1872 A 98 GLY H A 99 VAL HGy% 1.0 . 4.27 2456 1873 A 99 VAL H A 99 VAL HGx% 1.0 . 3.35 2457 1873 A 99 VAL H A 99 VAL HGy% 1.0 . 3.35 2458 1874 A 99 VAL HA A 99 VAL HGx% 1.0 . 2.52 2459 1874 A 99 VAL HA A 99 VAL HGy% 1.0 . 2.52 2460 1875 A 100 GLN H A 99 VAL HGx% 1.0 . 3.41 2461 1875 A 100 GLN H A 99 VAL HGy% 1.0 . 3.41 2462 1876 A 100 GLN HA A 99 VAL HGx% 1.0 . 3.53 2463 1876 A 100 GLN HA A 99 VAL HGy% 1.0 . 3.53 2464 1877 A 100 GLN HBy A 99 VAL HGx% 1.0 . 3.95 2465 1877 A 100 GLN HBy A 99 VAL HGy% 1.0 . 3.95 2466 1878 A 100 GLN HGy A 99 VAL HGx% 1.0 . 3.61 2467 1878 A 100 GLN HGy A 99 VAL HGy% 1.0 . 3.61 2468 1879 A 100 GLN HGx A 99 VAL HGx% 1.0 . 3.39 2469 1879 A 100 GLN HGx A 99 VAL HGy% 1.0 . 3.39 2470 1880 A 100 GLN HE2y A 99 VAL HGx% 1.0 . 4.03 2471 1880 A 100 GLN HE2y A 99 VAL HGy% 1.0 . 4.03 2472 1880 A 100 GLN HE2x A 99 VAL HGy% 1.0 . 4.03 2473 1880 A 100 GLN HE2x A 99 VAL HGx% 1.0 . 4.03 2474 1881 A 101 TRP HE1 A 99 VAL HGx% 1.0 . 4.87 2475 1881 A 101 TRP HE1 A 99 VAL HGy% 1.0 . 4.87 2476 1882 A 100 GLN HBy A 100 GLN HE2x 1.0 . 3.98 2477 1882 A 100 GLN HBy A 100 GLN HE2y 1.0 . 3.98 2478 1883 A 100 GLN HE2x A 100 GLN HBx 1.0 . 4.79 2479 1883 A 100 GLN HE2y A 100 GLN HBx 1.0 . 4.79 2480 1884 A 100 GLN HE2x A 100 GLN HGx 1.0 . 3.45 2481 1884 A 100 GLN HE2y A 100 GLN HGx 1.0 . 3.45 2482 1885 A 101 TRP HA A 103 VAL HGx% 1.0 . 5.44 2483 1885 A 101 TRP HA A 103 VAL HGy% 1.0 . 5.44 2484 1886 A 103 VAL H A 103 VAL HGx% 1.0 . 2.60 2485 1886 A 103 VAL H A 103 VAL HGy% 1.0 . 2.60 2486 1887 A 103 VAL HA A 103 VAL HGx% 1.0 . 2.51 2487 1887 A 103 VAL HA A 103 VAL HGy% 1.0 . 2.51 2488 1888 A 105 GLU H A 103 VAL HGx% 1.0 . 5.43 2489 1888 A 105 GLU H A 103 VAL HGy% 1.0 . 5.43 2490 1889 A 103 VAL HGy% A 110 SER HBy 1.0 . 3.55 2491 1889 A 103 VAL HGx% A 110 SER HBy 1.0 . 3.55 2492 1889 A 110 SER HBx A 103 VAL HGx% 1.0 . 3.55 2493 1889 A 103 VAL HGy% A 110 SER HBx 1.0 . 3.55 2494 1890 A 111 LYS H A 103 VAL HGx% 1.0 . 5.28 2495 1890 A 111 LYS H A 103 VAL HGy% 1.0 . 5.28 2496 1891 A 104 TYR H A 104 TYR HBx 1.0 . 3.52 2497 1891 A 104 TYR H A 104 TYR HBy 1.0 . 3.52 2498 1892 A 105 GLU H A 105 GLU HBx 1.0 . 3.16 2499 1892 A 105 GLU H A 105 GLU HBy 1.0 . 3.16 2500 1893 A 105 GLU H A 105 GLU HGx 1.0 . 3.60 2501 1893 A 105 GLU H A 105 GLU HGy 1.0 . 3.60 2502 1894 A 105 GLU HA A 110 SER HBy 1.0 . 4.63 2503 1894 A 105 GLU HA A 110 SER HBx 1.0 . 4.63 2504 1895 A 106 GLU H A 105 GLU HBx 1.0 . 3.94 2505 1895 A 106 GLU H A 105 GLU HBy 1.0 . 3.94 2506 1896 A 108 GLY H A 105 GLU HBx 1.0 . 4.36 2507 1896 A 108 GLY H A 105 GLU HBy 1.0 . 4.36 2508 1897 A 109 SER H A 105 GLU HBx 1.0 . 3.74 2509 1897 A 109 SER H A 105 GLU HBy 1.0 . 3.74 2510 1898 A 110 SER HA A 105 GLU HBx 1.0 . 3.36 2511 1898 A 110 SER HA A 105 GLU HBy 1.0 . 3.36 2512 1899 A 105 GLU HBy A 110 SER HBy 1.0 . 3.96 2513 1899 A 110 SER HBx A 105 GLU HBx 1.0 . 3.96 2514 1899 A 110 SER HBx A 105 GLU HBy 1.0 . 3.96 2515 1899 A 105 GLU HBx A 110 SER HBy 1.0 . 3.96 2516 1900 A 106 GLU H A 105 GLU HGx 1.0 . 4.24 2517 1900 A 106 GLU H A 105 GLU HGy 1.0 . 4.24 2518 1901 A 109 SER H A 105 GLU HGx 1.0 . 5.08 2519 1901 A 109 SER H A 105 GLU HGy 1.0 . 5.08 2520 1902 A 105 GLU HGy A 110 SER HBy 1.0 . 4.68 2521 1902 A 105 GLU HGx A 110 SER HBy 1.0 . 4.68 2522 1902 A 110 SER HBx A 105 GLU HGx 1.0 . 4.68 2523 1902 A 110 SER HBx A 105 GLU HGy 1.0 . 4.68 2524 1903 A 106 GLU H A 106 GLU HBy 1.0 . 3.66 2525 1903 A 106 GLU H A 106 GLU HBx 1.0 . 3.66 2526 1904 A 106 GLU HA A 106 GLU HGy 1.0 . 3.60 2527 1904 A 106 GLU HA A 106 GLU HGx 1.0 . 3.60 2528 1905 A 107 GLN H A 107 GLN HGx 1.0 . 4.27 2529 1905 A 107 GLN H A 107 GLN HGy 1.0 . 4.27 2530 1906 A 109 SER H A 107 GLN HBy 1.0 . 4.69 2531 1906 A 109 SER H A 107 GLN HBx 1.0 . 4.69 2532 1907 A 108 GLY H A 107 GLN HGx 1.0 . 4.14 2533 1907 A 108 GLY H A 107 GLN HGy 1.0 . 4.14 2534 1908 A 109 SER H A 107 GLN HGx 1.0 . 3.80 2535 1908 A 109 SER H A 107 GLN HGy 1.0 . 3.80 2536 1909 A 109 SER HA A 108 GLY HAy 1.0 . 4.40 2537 1909 A 109 SER HA A 108 GLY HAx 1.0 . 4.40 2538 1910 A 109 SER H A 109 SER HBy 1.0 . 3.62 2539 1910 A 109 SER H A 109 SER HBx 1.0 . 3.62 2540 1911 A 109 SER HA A 109 SER HBy 1.0 . 2.47 2541 1911 A 109 SER HA A 109 SER HBx 1.0 . 2.47 2542 1912 A 110 SER H A 109 SER HBy 1.0 . 4.13 2543 1912 A 109 SER HBx A 110 SER H 1.0 . 4.13 2544 1913 A 111 LYS H A 110 SER HBy 1.0 . 4.27 2545 1913 A 111 LYS H A 110 SER HBx 1.0 . 4.27 2546 1914 A 111 LYS H A 111 LYS HGx 1.0 . 4.63 2547 1914 A 111 LYS H A 111 LYS HGy 1.0 . 4.63 2548 1915 A 111 LYS H A 111 LYS HDx 1.0 . 4.59 2549 1915 A 111 LYS H A 111 LYS HDy 1.0 . 4.59 2550 1916 A 111 LYS HA A 111 LYS HGx 1.0 . 3.33 2551 1916 A 111 LYS HA A 111 LYS HGy 1.0 . 3.33 2552 1917 A 111 LYS HA A 111 LYS HDx 1.0 . 3.92 2553 1917 A 111 LYS HA A 111 LYS HDy 1.0 . 3.92 2554 1918 A 112 VAL H A 111 LYS HBy 1.0 . 3.98 2555 1918 A 112 VAL H A 111 LYS HBx 1.0 . 3.98 2556 1919 A 112 VAL H A 111 LYS HGx 1.0 . 3.47 2557 1919 A 112 VAL H A 111 LYS HGy 1.0 . 3.47 2558 1920 A 112 VAL H A 111 LYS HDx 1.0 . 3.62 2559 1920 A 112 VAL H A 111 LYS HDy 1.0 . 3.62 2560 1921 A 112 VAL H A 112 VAL HGx% 1.0 . 2.97 2561 1921 A 112 VAL H A 112 VAL HGy% 1.0 . 2.97 2562 1922 A 112 VAL HA A 112 VAL HGx% 1.0 . 2.72 2563 1922 A 112 VAL HA A 112 VAL HGy% 1.0 . 2.72 2564 1923 A 112 VAL HA A 113 PHE HBy 1.0 . 4.47 2565 1923 A 112 VAL HA A 113 PHE HBx 1.0 . 4.47 2566 1924 A 113 PHE H A 112 VAL HGx% 1.0 . 3.51 2567 1924 A 113 PHE H A 112 VAL HGy% 1.0 . 3.51 2568 1925 A 113 PHE HA A 112 VAL HGx% 1.0 . 4.35 2569 1925 A 113 PHE HA A 112 VAL HGy% 1.0 . 4.35 2570 1926 A 114 GLN H A 112 VAL HGx% 1.0 . 4.93 2571 1926 A 114 GLN H A 112 VAL HGy% 1.0 . 4.93 2572 1927 A 112 VAL HGx% A 141 VAL HGx% 1.0 . 3.41 2573 1927 A 112 VAL HGy% A 141 VAL HGx% 1.0 . 3.41 2574 1927 A 141 VAL HGy% A 112 VAL HGx% 1.0 . 3.41 2575 1927 A 141 VAL HGy% A 112 VAL HGy% 1.0 . 3.41 2576 1928 A 113 PHE H A 113 PHE HBy 1.0 . 3.31 2577 1928 A 113 PHE H A 113 PHE HBx 1.0 . 3.31 2578 1929 A 114 GLN H A 113 PHE HBy 1.0 . 4.33 2579 1929 A 114 GLN H A 113 PHE HBx 1.0 . 4.33 2580 1930 A 114 GLN H A 114 GLN HBx 1.0 . 3.05 2581 1930 A 114 GLN H A 114 GLN HBy 1.0 . 3.05 2582 1931 A 114 GLN H A 114 GLN HGx 1.0 . 4.08 2583 1931 A 114 GLN H A 114 GLN HGy 1.0 . 4.08 2584 1932 A 114 GLN H A 114 GLN HE2x 1.0 . 4.31 2585 1932 A 114 GLN H A 114 GLN HE2y 1.0 . 4.31 2586 1933 A 114 GLN HA A 114 GLN HGx 1.0 . 3.65 2587 1933 A 114 GLN HA A 114 GLN HGy 1.0 . 3.65 2588 1934 A 114 GLN HA A 114 GLN HE2x 1.0 . 4.60 2589 1934 A 114 GLN HA A 114 GLN HE2y 1.0 . 4.60 2590 1935 A 114 GLN HA A 115 GLY HAy 1.0 . 5.32 2591 1935 A 114 GLN HA A 115 GLY HAx 1.0 . 5.32 2592 1936 A 115 GLY H A 114 GLN HBx 1.0 . 3.45 2593 1936 A 115 GLY H A 114 GLN HBy 1.0 . 3.45 2594 1937 A 114 GLN HBy A 115 GLY HAy 1.0 . 5.18 2595 1937 A 114 GLN HBx A 115 GLY HAy 1.0 . 5.18 2596 1937 A 115 GLY HAx A 114 GLN HBx 1.0 . 5.18 2597 1937 A 115 GLY HAx A 114 GLN HBy 1.0 . 5.18 2598 1938 A 115 GLY H A 114 GLN HGx 1.0 . 4.33 2599 1938 A 115 GLY H A 114 GLN HGy 1.0 . 4.33 2600 1939 A 115 GLY H A 114 GLN HE2x 1.0 . 5.34 2601 1939 A 115 GLY H A 114 GLN HE2y 1.0 . 5.34 2602 1940 A 116 ASN H A 115 GLY HAy 1.0 . 3.10 2603 1940 A 116 ASN H A 115 GLY HAx 1.0 . 3.10 2604 1941 A 116 ASN HA A 115 GLY HAy 1.0 . 4.40 2605 1941 A 116 ASN HA A 115 GLY HAx 1.0 . 4.40 2606 1942 A 116 ASN HA A 117 LEU HBx 1.0 . 5.34 2607 1942 A 116 ASN HA A 117 LEU HBy 1.0 . 5.34 2608 1943 A 117 LEU H A 116 ASN HBx 1.0 . 3.65 2609 1943 A 117 LEU H A 116 ASN HBy 1.0 . 3.65 2610 1944 A 117 LEU HA A 116 ASN HBx 1.0 . 4.74 2611 1944 A 117 LEU HA A 116 ASN HBy 1.0 . 4.74 2612 1945 A 118 ASP H A 116 ASN HBx 1.0 . 3.44 2613 1945 A 118 ASP H A 116 ASN HBy 1.0 . 3.44 2614 1946 A 117 LEU H A 117 LEU HBx 1.0 . 3.56 2615 1946 A 117 LEU H A 117 LEU HBy 1.0 . 3.56 2616 1947 A 117 LEU H A 117 LEU HDx% 1.0 . 3.99 2617 1947 A 117 LEU H A 117 LEU HDy% 1.0 . 3.99 2618 1948 A 117 LEU HA A 117 LEU HDx% 1.0 . 2.77 2619 1948 A 117 LEU HA A 117 LEU HDy% 1.0 . 2.77 2620 1949 A 117 LEU HBx A 117 LEU HDx% 1.0 . 2.80 2621 1949 A 117 LEU HDy% A 117 LEU HBx 1.0 . 2.80 2622 1949 A 117 LEU HBy A 117 LEU HDy% 1.0 . 2.80 2623 1949 A 117 LEU HBy A 117 LEU HDx% 1.0 . 2.80 2624 1950 A 118 ASP H A 117 LEU HBx 1.0 . 3.99 2625 1950 A 118 ASP H A 117 LEU HBy 1.0 . 3.99 2626 1951 A 118 ASP H A 118 ASP HBy 1.0 . 3.64 2627 1951 A 118 ASP H A 118 ASP HBx 1.0 . 3.64 2628 1952 A 119 ASN H A 118 ASP HBy 1.0 . 3.29 2629 1952 A 119 ASN H A 118 ASP HBx 1.0 . 3.29 2630 1953 A 120 ASN H A 118 ASP HBy 1.0 . 4.09 2631 1953 A 120 ASN H A 118 ASP HBx 1.0 . 4.09 2632 1954 A 121 SER H A 118 ASP HBy 1.0 . 4.37 2633 1954 A 121 SER H A 118 ASP HBx 1.0 . 4.37 2634 1955 A 119 ASN H A 119 ASN HBy 1.0 . 3.54 2635 1955 A 119 ASN H A 119 ASN HBx 1.0 . 3.54 2636 1956 A 119 ASN H A 120 ASN HD2y 1.0 . 5.34 2637 1956 A 119 ASN H A 120 ASN HD2x 1.0 . 5.34 2638 1957 A 120 ASN H A 120 ASN HBx 1.0 . 3.15 2639 1957 A 120 ASN H A 120 ASN HBy 1.0 . 3.15 2640 1958 A 120 ASN H A 120 ASN HD2y 1.0 . 4.16 2641 1958 A 120 ASN H A 120 ASN HD2x 1.0 . 4.16 2642 1959 A 121 SER H A 120 ASN HBx 1.0 . 4.09 2643 1959 A 121 SER H A 120 ASN HBy 1.0 . 4.09 2644 1960 A 122 HIS H A 121 SER HBy 1.0 . 4.42 2645 1960 A 122 HIS H A 121 SER HBx 1.0 . 4.42 2646 1961 A 122 HIS H A 122 HIS HBx 1.0 . 3.20 2647 1961 A 122 HIS H A 122 HIS HBy 1.0 . 3.20 2648 1962 A 122 HIS H A 123 LYS HBy 1.0 . 5.34 2649 1962 A 122 HIS H A 123 LYS HBx 1.0 . 5.34 2650 1963 A 122 HIS HA A 123 LYS HBy 1.0 . 4.53 2651 1963 A 122 HIS HA A 123 LYS HBx 1.0 . 4.53 2652 1964 A 123 LYS H A 122 HIS HBx 1.0 . 3.83 2653 1964 A 123 LYS H A 122 HIS HBy 1.0 . 3.83 2654 1965 A 123 LYS HBy A 123 LYS HEx 1.0 . 4.76 2655 1965 A 123 LYS HBx A 123 LYS HEx 1.0 . 4.76 2656 1965 A 123 LYS HEy A 123 LYS HBy 1.0 . 4.76 2657 1965 A 123 LYS HBx A 123 LYS HEy 1.0 . 4.76 2658 1966 A 124 LYS H A 124 LYS HGx 1.0 . 4.85 2659 1966 A 124 LYS H A 124 LYS HGy 1.0 . 4.85 2660 1967 A 125 ASN H A 124 LYS HBy 1.0 . 4.37 2661 1967 A 125 ASN H A 124 LYS HBx 1.0 . 4.37 2662 1968 A 125 ASN H A 124 LYS HGx 1.0 . 3.94 2663 1968 A 125 ASN H A 124 LYS HGy 1.0 . 3.94 2664 1969 A 124 LYS HGy A 125 ASN HBx 1.0 . 5.18 2665 1969 A 124 LYS HGx A 125 ASN HBx 1.0 . 5.18 2666 1969 A 125 ASN HBy A 124 LYS HGx 1.0 . 5.18 2667 1969 A 125 ASN HBy A 124 LYS HGy 1.0 . 5.18 2668 1970 A 125 ASN H A 125 ASN HBx 1.0 . 3.65 2669 1970 A 125 ASN H A 125 ASN HBy 1.0 . 3.65 2670 1971 A 126 ILE H A 125 ASN HBx 1.0 . 3.52 2671 1971 A 126 ILE H A 125 ASN HBy 1.0 . 3.52 2672 1972 A 126 ILE HB A 125 ASN HBx 1.0 . 5.34 2673 1972 A 126 ILE HB A 125 ASN HBy 1.0 . 5.34 2674 1973 A 126 ILE H A 126 ILE HG1x 1.0 . 4.30 2675 1973 A 126 ILE H A 126 ILE HG1y 1.0 . 4.30 2676 1974 A 127 PHE H A 127 PHE HBy 1.0 . 3.39 2677 1974 A 127 PHE H A 127 PHE HBx 1.0 . 3.39 2678 1975 A 127 PHE H A 128 GLU HBy 1.0 . 5.34 2679 1975 A 127 PHE H A 128 GLU HBx 1.0 . 5.34 2680 1976 A 127 PHE HA A 128 GLU HBy 1.0 . 4.75 2681 1976 A 127 PHE HA A 128 GLU HBx 1.0 . 4.75 2682 1977 A 128 GLU H A 127 PHE HBy 1.0 . 4.26 2683 1977 A 128 GLU H A 127 PHE HBx 1.0 . 4.26 2684 1978 A 129 LYS H A 127 PHE HBy 1.0 . 4.56 2685 1978 A 129 LYS H A 127 PHE HBx 1.0 . 4.56 2686 1979 A 130 PRO HA A 127 PHE HBy 1.0 . 5.05 2687 1979 A 130 PRO HA A 127 PHE HBx 1.0 . 5.05 2688 1980 A 128 GLU H A 128 GLU HBy 1.0 . 3.17 2689 1980 A 128 GLU H A 128 GLU HBx 1.0 . 3.17 2690 1981 A 128 GLU HA A 128 GLU HGx 1.0 . 3.14 2691 1981 A 128 GLU HA A 128 GLU HGy 1.0 . 3.14 2692 1982 A 128 GLU HBx A 128 GLU HGx 1.0 . 2.34 2693 1982 A 128 GLU HBy A 128 GLU HGx 1.0 . 2.34 2694 1982 A 128 GLU HGy A 128 GLU HBy 1.0 . 2.34 2695 1982 A 128 GLU HBx A 128 GLU HGy 1.0 . 2.34 2696 1983 A 129 LYS H A 128 GLU HBy 1.0 . 4.39 2697 1983 A 129 LYS H A 128 GLU HBx 1.0 . 4.39 2698 1984 A 128 GLU HBy A 129 LYS HGx 1.0 . 4.30 2699 1984 A 128 GLU HBx A 129 LYS HGx 1.0 . 4.30 2700 1984 A 129 LYS HGy A 128 GLU HBy 1.0 . 4.30 2701 1984 A 128 GLU HBx A 129 LYS HGy 1.0 . 4.30 2702 1985 A 129 LYS H A 128 GLU HGx 1.0 . 4.85 2703 1985 A 129 LYS H A 128 GLU HGy 1.0 . 4.85 2704 1986 A 129 LYS H A 129 LYS HGx 1.0 . 3.86 2705 1986 A 129 LYS H A 129 LYS HGy 1.0 . 3.86 2706 1987 A 129 LYS H A 129 LYS HDy 1.0 . 5.34 2707 1987 A 129 LYS H A 129 LYS HDx 1.0 . 5.34 2708 1988 A 129 LYS H A 130 PRO HDx 1.0 . 4.15 2709 1988 A 129 LYS H A 130 PRO HDy 1.0 . 4.15 2710 1989 A 129 LYS HA A 129 LYS HGx 1.0 . 3.72 2711 1989 A 129 LYS HA A 129 LYS HGy 1.0 . 3.72 2712 1990 A 129 LYS HA A 130 PRO HDx 1.0 . 3.17 2713 1990 A 129 LYS HA A 130 PRO HDy 1.0 . 3.17 2714 1991 A 130 PRO HA A 131 PHE HBy 1.0 . 4.46 2715 1991 A 130 PRO HA A 131 PHE HBx 1.0 . 4.46 2716 1992 A 131 PHE H A 131 PHE HBy 1.0 . 3.66 2717 1992 A 131 PHE H A 131 PHE HBx 1.0 . 3.66 2718 1993 A 131 PHE HA A 132 MET HBx 1.0 . 5.34 2719 1993 A 131 PHE HA A 132 MET HBy 1.0 . 5.34 2720 1994 A 132 MET H A 131 PHE HBy 1.0 . 3.87 2721 1994 A 132 MET H A 131 PHE HBx 1.0 . 3.87 2722 1995 A 132 MET H A 132 MET HBx 1.0 . 3.58 2723 1995 A 132 MET H A 132 MET HBy 1.0 . 3.58 2724 1996 A 132 MET H A 132 MET HGx 1.0 . 3.05 2725 1996 A 132 MET H A 132 MET HGy 1.0 . 3.05 2726 1997 A 132 MET HE% A 132 MET HGx 1.0 . 3.43 2727 1997 A 132 MET HE% A 132 MET HGy 1.0 . 3.43 2728 1998 A 133 ALA H A 132 MET HGx 1.0 . 4.82 2729 1998 A 133 ALA H A 132 MET HGy 1.0 . 4.82 2730 1999 A 134 ARG H A 134 ARG HGy 1.0 . 4.76 2731 1999 A 134 ARG H A 134 ARG HGx 1.0 . 4.76 2732 2000 A 135 TYR H A 134 ARG HGy 1.0 . 4.83 2733 2000 A 135 TYR H A 134 ARG HGx 1.0 . 4.83 2734 2001 A 134 ARG HE A 135 TYR HBy 1.0 . 3.95 2735 2001 A 134 ARG HE A 135 TYR HBx 1.0 . 3.95 2736 2002 A 135 TYR H A 135 TYR HBy 1.0 . 3.61 2737 2002 A 135 TYR H A 135 TYR HBx 1.0 . 3.61 2738 2003 A 136 VAL HA A 138 VAL HGx% 1.0 . 5.44 2739 2003 A 136 VAL HA A 138 VAL HGy% 1.0 . 5.44 2740 2004 A 136 VAL HGy% A 138 VAL HGx% 1.0 . 3.16 2741 2004 A 136 VAL HGy% A 138 VAL HGy% 1.0 . 3.16 2742 2005 A 137 ARG HA A 138 VAL HGx% 1.0 . 4.33 2743 2005 A 137 ARG HA A 138 VAL HGy% 1.0 . 4.33 2744 2006 A 138 VAL H A 137 ARG HGx 1.0 . 3.60 2745 2006 A 138 VAL H A 137 ARG HGy 1.0 . 3.60 2746 2007 A 138 VAL H A 138 VAL HGx% 1.0 . 3.19 2747 2007 A 138 VAL H A 138 VAL HGy% 1.0 . 3.19 2748 2008 A 138 VAL HA A 138 VAL HGx% 1.0 . 3.08 2749 2008 A 138 VAL HA A 138 VAL HGy% 1.0 . 3.08 2750 2009 A 139 LEU H A 138 VAL HGx% 1.0 . 3.20 2751 2009 A 139 LEU H A 138 VAL HGy% 1.0 . 3.20 2752 2010 A 139 LEU H A 139 LEU HDy% 1.0 . 4.35 2753 2010 A 139 LEU H A 139 LEU HDx% 1.0 . 4.35 2754 2011 A 140 PRO HA A 141 VAL HGx% 1.0 . 4.34 2755 2011 A 140 PRO HA A 141 VAL HGy% 1.0 . 4.34 2756 2012 A 141 VAL H A 140 PRO HBy 1.0 . 3.95 2757 2012 A 141 VAL H A 140 PRO HBx 1.0 . 3.95 2758 2013 A 141 VAL H A 140 PRO HDx 1.0 . 4.96 2759 2013 A 141 VAL H A 140 PRO HDy 1.0 . 4.96 2760 2014 A 147 ILE HG2% A 140 PRO HDx 1.0 . 4.13 2761 2014 A 147 ILE HG2% A 140 PRO HDy 1.0 . 4.13 2762 2015 A 141 VAL H A 141 VAL HGx% 1.0 . 3.29 2763 2015 A 141 VAL H A 141 VAL HGy% 1.0 . 3.29 2764 2016 A 141 VAL HA A 141 VAL HGx% 1.0 . 2.77 2765 2016 A 141 VAL HA A 141 VAL HGy% 1.0 . 2.77 2766 2017 A 142 SER H A 141 VAL HGx% 1.0 . 3.24 2767 2017 A 142 SER H A 141 VAL HGy% 1.0 . 3.24 2768 2018 A 142 SER HA A 141 VAL HGx% 1.0 . 3.95 2769 2018 A 142 SER HA A 141 VAL HGy% 1.0 . 3.95 2770 2019 A 143 TRP H A 142 SER HBx 1.0 . 3.44 2771 2019 A 143 TRP H A 142 SER HBy 1.0 . 3.44 2772 2020 A 147 ILE HA A 143 TRP HBy 1.0 . 4.83 2773 2020 A 147 ILE HA A 143 TRP HBx 1.0 . 4.83 2774 2021 A 147 ILE HD1% A 143 TRP HBy 1.0 . 5.00 2775 2021 A 147 ILE HD1% A 143 TRP HBx 1.0 . 5.00 2776 2022 A 144 HIS H A 144 HIS HBy 1.0 . 3.52 2777 2022 A 144 HIS H A 144 HIS HBx 1.0 . 3.52 2778 2023 A 145 ASN H A 144 HIS HBy 1.0 . 3.65 2779 2023 A 145 ASN H A 144 HIS HBx 1.0 . 3.65 2780 2024 A 145 ASN H A 145 ASN HBy 1.0 . 3.64 2781 2024 A 145 ASN H A 145 ASN HBx 1.0 . 3.64 2782 2025 A 146 ARG H A 145 ASN HBy 1.0 . 4.11 2783 2025 A 146 ARG H A 145 ASN HBx 1.0 . 4.11 2784 2026 A 146 ARG H A 146 ARG HBy 1.0 . 3.68 2785 2026 A 146 ARG H A 146 ARG HBx 1.0 . 3.68 2786 2027 A 146 ARG H A 146 ARG HGx 1.0 . 4.23 2787 2027 A 146 ARG H A 146 ARG HGy 1.0 . 4.23 2788 2028 A 146 ARG HA A 146 ARG HGx 1.0 . 3.12 2789 2028 A 146 ARG HA A 146 ARG HGy 1.0 . 3.12 2790 2029 A 146 ARG HA A 146 ARG HDy 1.0 . 3.61 2791 2029 A 146 ARG HA A 146 ARG HDx 1.0 . 3.61 2792 2030 A 146 ARG HBy A 146 ARG HDy 1.0 . 3.34 2793 2030 A 146 ARG HBx A 146 ARG HDy 1.0 . 3.34 2794 2030 A 146 ARG HDx A 146 ARG HBy 1.0 . 3.34 2795 2030 A 146 ARG HBx A 146 ARG HDx 1.0 . 3.34 2796 2031 A 146 ARG HE A 146 ARG HBy 1.0 . 4.83 2797 2031 A 146 ARG HE A 146 ARG HBx 1.0 . 4.83 2798 2032 A 147 ILE H A 146 ARG HDy 1.0 . 4.62 2799 2032 A 147 ILE H A 146 ARG HDx 1.0 . 4.62 2800 2033 A 147 ILE HD1% A 146 ARG HDy 1.0 . 3.60 2801 2033 A 147 ILE HD1% A 146 ARG HDx 1.0 . 3.60 2802 2034 A 147 ILE H A 147 ILE HG1x 1.0 . 3.94 2803 2034 A 147 ILE H A 147 ILE HG1y 1.0 . 3.94 2804 2035 A 147 ILE HA A 147 ILE HG1x 1.0 . 3.59 2805 2035 A 147 ILE HA A 147 ILE HG1y 1.0 . 3.59 2806 2036 A 147 ILE HA A 149 LEU HBy 1.0 . 5.34 2807 2036 A 147 ILE HA A 149 LEU HBx 1.0 . 5.34 2808 2037 A 147 ILE HG2% A 147 ILE HG1x 1.0 . 2.93 2809 2037 A 147 ILE HG2% A 147 ILE HG1y 1.0 . 2.93 2810 2038 A 147 ILE HG2% A 149 LEU HBy 1.0 . 4.73 2811 2038 A 147 ILE HG2% A 149 LEU HBx 1.0 . 4.73 2812 2039 A 148 THR H A 147 ILE HG1x 1.0 . 5.03 2813 2039 A 148 THR H A 147 ILE HG1y 1.0 . 5.03 2814 2040 A 148 THR HA A 149 LEU HBy 1.0 . 4.50 2815 2040 A 148 THR HA A 149 LEU HBx 1.0 . 4.50 2816 2041 A 149 LEU H A 149 LEU HBy 1.0 . 3.32 2817 2041 A 149 LEU H A 149 LEU HBx 1.0 . 3.32 2818 2042 A 150 ARG H A 149 LEU HDy% 1.0 . 3.90 2819 2042 A 150 ARG H A 149 LEU HDx% 1.0 . 3.90 2820 2043 A 150 ARG HA A 150 ARG HGy 1.0 . 3.59 2821 2043 A 150 ARG HA A 150 ARG HGx 1.0 . 3.59 2822 2044 A 152 GLU H A 152 GLU HGy 1.0 . 4.77 2823 2044 A 152 GLU H A 152 GLU HGx 1.0 . 4.77 2824 2045 A 153 LEU H A 152 GLU HGy 1.0 . 4.84 2825 2045 A 153 LEU H A 152 GLU HGx 1.0 . 4.84 2826 2046 A 153 LEU H A 153 LEU HDx% 1.0 . 3.91 2827 2046 A 153 LEU H A 153 LEU HDy% 1.0 . 3.91 2828 2047 A 153 LEU HA A 153 LEU HDx% 1.0 . 3.75 2829 2047 A 153 LEU HA A 153 LEU HDy% 1.0 . 3.75 2830 2048 A 154 LEU H A 153 LEU HBx 1.0 . 3.48 2831 2048 A 154 LEU H A 153 LEU HBy 1.0 . 3.48 2832 2049 A 154 LEU H A 153 LEU HDx% 1.0 . 4.43 2833 2049 A 154 LEU H A 153 LEU HDy% 1.0 . 4.43 2834 2050 A 154 LEU H A 154 LEU HDy% 1.0 . 4.77 2835 2050 A 154 LEU H A 154 LEU HDx% 1.0 . 4.77 2836 2051 A 154 LEU HA A 154 LEU HDy% 1.0 . 3.24 2837 2051 A 154 LEU HA A 154 LEU HDx% 1.0 . 3.24 2838 2052 A 155 GLY H A 154 LEU HDy% 1.0 . 4.21 2839 2052 A 155 GLY H A 154 LEU HDx% 1.0 . 4.21 2840 2053 A 156 CYS H A 156 CYS HBx 1.0 . 3.29 2841 2053 A 156 CYS H A 156 CYS HBy 1.0 . 3.29 2842 2054 A 157 LEU H A 156 CYS HBx 1.0 . 3.91 2843 2054 A 157 LEU H A 156 CYS HBy 1.0 . 3.91 2844 2055 A 157 LEU HA A 156 CYS HBx 1.0 . 5.34 2845 2055 A 157 LEU HA A 156 CYS HBy 1.0 . 5.34 2846 2056 A 156 CYS HBx A 157 LEU HBx 1.0 . 4.76 2847 2056 A 157 LEU HBy A 156 CYS HBx 1.0 . 4.76 2848 2056 A 156 CYS HBy A 157 LEU HBy 1.0 . 4.76 2849 2056 A 156 CYS HBy A 157 LEU HBx 1.0 . 4.76 2850 2057 A 158 GLU H A 156 CYS HBx 1.0 . 3.80 2851 2057 A 158 GLU H A 156 CYS HBy 1.0 . 3.80 2852 2058 A 157 LEU H A 157 LEU HBx 1.0 . 3.01 2853 2058 A 157 LEU H A 157 LEU HBy 1.0 . 3.01 2854 2059 A 157 LEU H A 157 LEU HDy% 1.0 . 3.89 2855 2059 A 157 LEU H A 157 LEU HDx% 1.0 . 3.89 2856 2060 A 157 LEU H A 158 GLU HBx 1.0 . 5.07 2857 2060 A 157 LEU H A 158 GLU HBy 1.0 . 5.07 2858 2061 A 157 LEU HA A 157 LEU HDy% 1.0 . 2.87 2859 2061 A 157 LEU HA A 157 LEU HDx% 1.0 . 2.87 2860 2062 A 157 LEU HBx A 157 LEU HDy% 1.0 . 2.32 2861 2062 A 157 LEU HBy A 157 LEU HDy% 1.0 . 2.32 2862 2062 A 157 LEU HDx% A 157 LEU HBx 1.0 . 2.32 2863 2062 A 157 LEU HDx% A 157 LEU HBy 1.0 . 2.32 2864 2063 A 158 GLU HA A 157 LEU HBx 1.0 . 4.62 2865 2063 A 158 GLU HA A 157 LEU HBy 1.0 . 4.62 2866 2064 A 158 GLU HA A 157 LEU HDy% 1.0 . 4.52 2867 2064 A 158 GLU HA A 157 LEU HDx% 1.0 . 4.52 2868 2065 A 158 GLU H A 158 GLU HBx 1.0 . 2.87 2869 2065 A 158 GLU H A 158 GLU HBy 1.0 . 2.87 2870 2066 A 158 GLU H A 158 GLU HGy 1.0 . 4.66 2871 2066 A 158 GLU H A 158 GLU HGx 1.0 . 4.66 2872 2067 A 158 GLU HA A 158 GLU HGy 1.0 . 3.58 2873 2067 A 158 GLU HA A 158 GLU HGx 1.0 . 3.58 stop_ save_ save_DYANA/DIANA_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_5 _nef_distance_restraint_list.restraint_origin disulfide_bond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 CYS SG A 156 CYS SG 1.0 . 2.06 2 2 A 1 CYS SG A 156 CYS CB 1.0 . 3.10 3 3 A 156 CYS SG A 1 CYS CB 1.0 . 3.10 4 4 A 1 CYS SG A 156 CYS SG 1.0 . 2.04 5 5 A 1 CYS SG A 156 CYS CB 1.0 . 3.00 6 6 A 156 CYS SG A 1 CYS CB 1.0 . 3.00 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 60 LEU H A 138 VAL O 1.0 . 2.0 2 2 A 138 VAL O A 60 LEU N 1.0 . 3.0 3 3 A 62 VAL H A 136 VAL O 1.0 . 2.0 4 4 A 136 VAL O A 62 VAL N 1.0 . 3.0 5 5 A 63 ASP H A 16 GLN O 1.0 . 2.0 6 6 A 16 GLN O A 63 ASP N 1.0 . 3.0 7 7 A 64 LEU H A 134 ARG O 1.0 . 2.0 8 8 A 134 ARG O A 64 LEU N 1.0 . 3.0 9 9 A 68 ARG H A 133 ALA O 1.0 . 2.0 10 10 A 133 ALA O A 68 ARG N 1.0 . 3.0 11 11 A 70 VAL H A 131 PHE O 1.0 . 2.0 12 12 A 131 PHE O A 70 VAL N 1.0 . 3.0 13 13 A 72 GLY N A 154 LEU O 1.0 . 3.0 14 14 A 73 ILE H A 125 ASN O 1.0 . 2.0 15 15 A 125 ASN O A 73 ILE N 1.0 . 3.0 16 16 A 74 ILE H A 152 GLU O 1.0 . 2.0 17 17 A 152 GLU O A 74 ILE N 1.0 . 3.0 18 18 A 75 THR H A 123 LYS O 1.0 . 2.0 19 19 A 123 LYS O A 75 THR N 1.0 . 3.0 20 20 A 76 GLN H A 150 ARG O 1.0 . 2.0 21 21 A 150 ARG O A 76 GLN N 1.0 . 3.0 22 22 A 89 SER H A 142 SER O 1.0 . 2.0 23 23 A 142 SER O A 89 SER N 1.0 . 3.0 24 24 A 90 TYR H A 113 PHE O 1.0 . 2.0 25 25 A 113 PHE O A 90 TYR N 1.0 . 3.0 26 26 A 91 LYS H A 139 LEU O 1.0 . 2.0 27 27 A 139 LEU O A 91 LYS N 1.0 . 3.0 28 28 A 93 ALA H A 137 ARG O 1.0 . 2.0 29 29 A 137 ARG O A 93 ALA N 1.0 . 3.0 30 30 A 94 HIS H A 102 THR O 1.0 . 2.0 31 31 A 102 THR O A 94 HIS N 1.0 . 3.0 32 32 A 95 SER H A 135 TYR O 1.0 . 2.0 33 33 A 135 TYR O A 95 SER N 1.0 . 3.0 34 34 A 102 THR H A 94 HIS O 1.0 . 2.0 35 35 A 94 HIS O A 102 THR N 1.0 . 3.0 36 36 A 113 PHE H A 90 TYR O 1.0 . 2.0 37 37 A 90 TYR O A 113 PHE N 1.0 . 3.0 38 38 A 131 PHE H A 70 VAL O 1.0 . 2.0 39 39 A 70 VAL O A 131 PHE N 1.0 . 3.0 40 40 A 133 ALA H A 68 ARG O 1.0 . 2.0 41 41 A 68 ARG O A 133 ALA N 1.0 . 3.0 42 42 A 135 TYR H A 95 SER O 1.0 . 2.0 43 43 A 95 SER O A 135 TYR N 1.0 . 3.0 44 44 A 136 VAL H A 62 VAL O 1.0 . 2.0 45 45 A 62 VAL O A 136 VAL N 1.0 . 3.0 46 46 A 137 ARG H A 93 ALA O 1.0 . 2.0 47 47 A 93 ALA O A 137 ARG N 1.0 . 3.0 48 48 A 138 VAL H A 60 LEU O 1.0 . 2.0 49 49 A 60 LEU O A 138 VAL N 1.0 . 3.0 50 50 A 139 LEU H A 91 LYS O 1.0 . 2.0 51 51 A 91 LYS O A 139 LEU N 1.0 . 3.0 52 52 A 141 VAL H A 89 SER O 1.0 . 2.0 53 53 A 89 SER O A 141 VAL N 1.0 . 3.0 54 54 A 150 ARG H A 76 GLN O 1.0 . 2.0 55 55 A 76 GLN O A 150 ARG N 1.0 . 3.0 56 56 A 152 GLU H A 74 ILE O 1.0 . 2.0 57 57 A 74 ILE O A 152 GLU N 1.0 . 3.0 58 58 A 154 LEU H A 72 GLY O 1.0 . 2.0 59 59 A 72 GLY O A 154 LEU N 1.0 . 3.0 60 60 A 18 SER H A 61 GLN O 1.0 . 2.0 61 61 A 61 GLN O A 18 SER N 1.0 . 3.0 62 62 A 20 SER H A 59 TRP O 1.0 . 2.0 63 63 A 59 TRP O A 20 SER N 1.0 . 3.0 64 64 A 49 TRP H A 149 LEU O 1.0 . 2.0 65 65 A 149 LEU O A 49 TRP N 1.0 . 3.0 66 66 A 51 ALA H A 147 ILE O 1.0 . 2.0 67 67 A 147 ILE O A 51 ALA N 1.0 . 3.0 68 68 A 61 GLN H A 18 SER O 1.0 . 2.0 69 69 A 18 SER O A 61 GLN N 1.0 . 3.0 70 70 A 78 ALA H A 148 THR O 1.0 . 2.0 71 71 A 148 THR O A 78 ALA N 1.0 . 3.0 72 72 A 85 GLN H A 78 ALA O 1.0 . 2.0 73 73 A 78 ALA O A 85 GLN N 1.0 . 3.0 74 74 A 86 TYR H A 144 HIS O 1.0 . 2.0 75 75 A 144 HIS O A 86 TYR N 1.0 . 3.0 76 76 A 115 GLY H A 88 ALA O 1.0 . 2.0 77 77 A 88 ALA O A 115 GLY N 1.0 . 3.0 78 78 A 123 LYS H A 75 THR O 1.0 . 2.0 79 79 A 75 THR O A 123 LYS N 1.0 . 3.0 80 80 A 125 ASN H A 73 ILE O 1.0 . 2.0 81 81 A 73 ILE O A 125 ASN N 1.0 . 3.0 82 82 A 144 HIS H A 86 TYR O 1.0 . 2.0 83 83 A 86 TYR O A 144 HIS N 1.0 . 3.0 84 84 A 149 LEU H A 49 TRP O 1.0 . 2.0 85 85 A 49 TRP O A 149 LEU N 1.0 . 3.0 86 86 A 155 GLY H A 3 GLU O 1.0 . 2.0 87 87 A 3 GLU O A 155 GLY N 1.0 . 3.0 88 88 A 3 GLU H A 155 GLY O 1.0 . 2.0 89 89 A 155 GLY O A 3 GLU N 1.0 . 3.0 90 90 A 142 SER H A 89 SER O 1.0 . 2.0 91 91 A 89 SER O A 142 SER N 1.0 . 3.0 92 92 A 65 GLY H A 134 ARG O 1.0 . 2.0 93 93 A 134 ARG O A 65 GLY N 1.0 . 3.0 94 94 A 71 THR H A 154 LEU O 1.0 . 2.0 95 95 A 154 LEU O A 71 THR N 1.0 . 3.0 96 96 A 88 ALA H A 142 SER O 1.0 . 2.0 97 97 A 142 SER O A 88 ALA N 1.0 . 3.0 98 98 A 134 ARG H A 95 SER O 1.0 . 2.0 99 99 A 95 SER O A 134 ARG N 1.0 . 3.0 100 100 A 60 LEU H A 138 VAL O 1.0 . 1.8 101 101 A 138 VAL O A 60 LEU N 1.0 . 2.7 102 102 A 62 VAL H A 136 VAL O 1.0 . 1.8 103 103 A 136 VAL O A 62 VAL N 1.0 . 2.7 104 104 A 63 ASP H A 16 GLN O 1.0 . 1.8 105 105 A 16 GLN O A 63 ASP N 1.0 . 2.7 106 106 A 64 LEU H A 134 ARG O 1.0 . 1.8 107 107 A 134 ARG O A 64 LEU N 1.0 . 2.7 108 108 A 68 ARG H A 133 ALA O 1.0 . 1.8 109 109 A 133 ALA O A 68 ARG N 1.0 . 2.7 110 110 A 70 VAL H A 131 PHE O 1.0 . 1.8 111 111 A 131 PHE O A 70 VAL N 1.0 . 2.7 112 112 A 72 GLY N A 154 LEU O 1.0 . 2.7 113 113 A 73 ILE H A 125 ASN O 1.0 . 1.8 114 114 A 125 ASN O A 73 ILE N 1.0 . 2.7 115 115 A 74 ILE H A 152 GLU O 1.0 . 1.8 116 116 A 152 GLU O A 74 ILE N 1.0 . 2.7 117 117 A 75 THR H A 123 LYS O 1.0 . 1.8 118 118 A 123 LYS O A 75 THR N 1.0 . 2.7 119 119 A 76 GLN H A 150 ARG O 1.0 . 1.8 120 120 A 150 ARG O A 76 GLN N 1.0 . 2.7 121 121 A 89 SER H A 142 SER O 1.0 . 1.8 122 122 A 142 SER O A 89 SER N 1.0 . 2.7 123 123 A 90 TYR H A 113 PHE O 1.0 . 1.8 124 124 A 113 PHE O A 90 TYR N 1.0 . 2.7 125 125 A 91 LYS H A 139 LEU O 1.0 . 1.8 126 126 A 139 LEU O A 91 LYS N 1.0 . 2.7 127 127 A 93 ALA H A 137 ARG O 1.0 . 1.8 128 128 A 137 ARG O A 93 ALA N 1.0 . 2.7 129 129 A 94 HIS H A 102 THR O 1.0 . 1.8 130 130 A 102 THR O A 94 HIS N 1.0 . 2.7 131 131 A 95 SER H A 135 TYR O 1.0 . 1.8 132 132 A 135 TYR O A 95 SER N 1.0 . 2.7 133 133 A 102 THR H A 94 HIS O 1.0 . 1.8 134 134 A 94 HIS O A 102 THR N 1.0 . 2.7 135 135 A 113 PHE H A 90 TYR O 1.0 . 1.8 136 136 A 90 TYR O A 113 PHE N 1.0 . 2.7 137 137 A 131 PHE H A 70 VAL O 1.0 . 1.8 138 138 A 70 VAL O A 131 PHE N 1.0 . 2.7 139 139 A 133 ALA H A 68 ARG O 1.0 . 1.8 140 140 A 68 ARG O A 133 ALA N 1.0 . 2.7 141 141 A 135 TYR H A 95 SER O 1.0 . 1.8 142 142 A 95 SER O A 135 TYR N 1.0 . 2.7 143 143 A 136 VAL H A 62 VAL O 1.0 . 1.8 144 144 A 62 VAL O A 136 VAL N 1.0 . 2.7 145 145 A 137 ARG H A 93 ALA O 1.0 . 1.8 146 146 A 93 ALA O A 137 ARG N 1.0 . 2.7 147 147 A 138 VAL H A 60 LEU O 1.0 . 1.8 148 148 A 60 LEU O A 138 VAL N 1.0 . 2.7 149 149 A 139 LEU H A 91 LYS O 1.0 . 1.8 150 150 A 91 LYS O A 139 LEU N 1.0 . 2.7 151 151 A 141 VAL H A 89 SER O 1.0 . 1.8 152 152 A 89 SER O A 141 VAL N 1.0 . 2.7 153 153 A 150 ARG H A 76 GLN O 1.0 . 1.8 154 154 A 76 GLN O A 150 ARG N 1.0 . 2.7 155 155 A 152 GLU H A 74 ILE O 1.0 . 1.8 156 156 A 74 ILE O A 152 GLU N 1.0 . 2.7 157 157 A 154 LEU H A 72 GLY O 1.0 . 1.8 158 158 A 72 GLY O A 154 LEU N 1.0 . 2.7 159 159 A 18 SER H A 61 GLN O 1.0 . 1.8 160 160 A 61 GLN O A 18 SER N 1.0 . 2.7 161 161 A 20 SER H A 59 TRP O 1.0 . 1.8 162 162 A 59 TRP O A 20 SER N 1.0 . 2.7 163 163 A 49 TRP H A 149 LEU O 1.0 . 1.8 164 164 A 149 LEU O A 49 TRP N 1.0 . 2.7 165 165 A 51 ALA H A 147 ILE O 1.0 . 1.8 166 166 A 147 ILE O A 51 ALA N 1.0 . 2.7 167 167 A 61 GLN H A 18 SER O 1.0 . 1.8 168 168 A 18 SER O A 61 GLN N 1.0 . 2.7 169 169 A 78 ALA H A 148 THR O 1.0 . 1.8 170 170 A 148 THR O A 78 ALA N 1.0 . 2.7 171 171 A 85 GLN H A 78 ALA O 1.0 . 1.8 172 172 A 78 ALA O A 85 GLN N 1.0 . 2.7 173 173 A 86 TYR H A 144 HIS O 1.0 . 1.8 174 174 A 144 HIS O A 86 TYR N 1.0 . 2.7 175 175 A 115 GLY H A 88 ALA O 1.0 . 1.8 176 176 A 88 ALA O A 115 GLY N 1.0 . 2.7 177 177 A 123 LYS H A 75 THR O 1.0 . 1.8 178 178 A 75 THR O A 123 LYS N 1.0 . 2.7 179 179 A 125 ASN H A 73 ILE O 1.0 . 1.8 180 180 A 73 ILE O A 125 ASN N 1.0 . 2.7 181 181 A 144 HIS H A 86 TYR O 1.0 . 1.8 182 182 A 86 TYR O A 144 HIS N 1.0 . 2.7 183 183 A 149 LEU H A 49 TRP O 1.0 . 1.8 184 184 A 49 TRP O A 149 LEU N 1.0 . 2.7 185 185 A 155 GLY H A 3 GLU O 1.0 . 1.8 186 186 A 3 GLU O A 155 GLY N 1.0 . 2.7 187 187 A 3 GLU H A 155 GLY O 1.0 . 1.8 188 188 A 155 GLY O A 3 GLU N 1.0 . 2.7 189 189 A 142 SER H A 89 SER O 1.0 . 1.8 190 190 A 89 SER O A 142 SER N 1.0 . 2.7 191 191 A 65 GLY H A 134 ARG O 1.0 . 1.8 192 192 A 134 ARG O A 65 GLY N 1.0 . 2.7 193 193 A 71 THR H A 154 LEU O 1.0 . 1.8 194 194 A 154 LEU O A 71 THR N 1.0 . 2.7 195 195 A 88 ALA H A 142 SER O 1.0 . 1.8 196 196 A 142 SER O A 88 ALA N 1.0 . 2.7 197 197 A 134 ARG H A 95 SER O 1.0 . 1.8 198 198 A 95 SER O A 134 ARG N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type undefined _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A -2 GLY C A -1 HIS N A -1 HIS CA A -1 HIS C 1.0 -97.0 24.0 PHI 2 2 A -1 HIS N A -1 HIS CA A -1 HIS C A 0 GLY N 1.0 130.0 406.5 PSI 3 3 A 0 GLY C A 1 CYS N A 1 CYS CA A 1 CYS C 1.0 -122.0 19.5 PHI 4 4 A 1 CYS N A 1 CYS CA A 1 CYS C A 2 SER N 1.0 144.0 385.5 PSI 5 5 A 4 PRO N A 4 PRO CA A 4 PRO C A 5 LEU N 1.0 144.0 385.5 PSI 6 6 A 11 THR C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -87.0 39.0 PHI 7 7 A 13 PRO N A 13 PRO CA A 13 PRO C A 14 ASP N 1.0 154.0 372.0 PSI 8 8 A 18 SER C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -135.0 31.5 PHI 9 9 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 SER N 1.0 160.0 376.5 PSI 10 10 A 19 ALA C A 20 SER N A 20 SER CA A 20 SER C 1.0 -120.0 31.5 PHI 11 11 A 20 SER N A 20 SER CA A 20 SER C A 21 SER N 1.0 141.0 390.0 PSI 12 12 A 23 TYR C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -103.0 27.0 PHI 13 13 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 THR N 1.0 119.0 387.0 PSI 14 14 A 32 GLY C A 33 TRP N A 33 TRP CA A 33 TRP C 1.0 -110.0 36.0 PHI 15 15 A 33 TRP N A 33 TRP CA A 33 TRP C A 34 TYR N 1.0 125.0 420.0 PSI 16 16 A 38 GLY C A 39 ARG N A 39 ARG CA A 39 ARG C 1.0 -111.0 34.5 PHI 17 17 A 39 ARG N A 39 ARG CA A 39 ARG C A 40 LEU N 1.0 127.0 397.5 PSI 18 18 A 41 ASP C A 42 ASN N A 42 ASN CA A 42 ASN C 1.0 -83.0 30.0 PHI 19 19 A 42 ASN N A 42 ASN CA A 42 ASN C A 43 GLN N 1.0 127.0 399.0 PSI 20 20 A 42 ASN C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -118.0 33.0 PHI 21 21 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 GLY N 1.0 139.0 397.5 PSI 22 22 A 48 ALA C A 49 TRP N A 49 TRP CA A 49 TRP C 1.0 -93.0 19.5 PHI 23 23 A 49 TRP N A 49 TRP CA A 49 TRP C A 50 THR N 1.0 115.0 367.5 PSI 24 24 A 49 TRP C A 50 THR N A 50 THR CA A 50 THR C 1.0 -111.0 18.0 PHI 25 25 A 50 THR N A 50 THR CA A 50 THR C A 51 ALA N 1.0 133.0 384.0 PSI 26 26 A 54 ASN C A 55 SER N A 55 SER CA A 55 SER C 1.0 -128.0 37.5 PHI 27 27 A 55 SER N A 55 SER CA A 55 SER C A 56 ALA N 1.0 151.0 391.5 PSI 28 28 A 59 TRP C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -115.0 39.0 PHI 29 29 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 GLN N 1.0 126.0 391.5 PSI 30 30 A 60 LEU C A 61 GLN N A 61 GLN CA A 61 GLN C 1.0 -121.0 19.5 PHI 31 31 A 61 GLN N A 61 GLN CA A 61 GLN C A 62 VAL N 1.0 132.0 379.5 PSI 32 32 A 61 GLN C A 62 VAL N A 62 VAL CA A 62 VAL C 1.0 -127.0 27.0 PHI 33 33 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 LEU N 1.0 125.0 376.5 PSI 34 34 A 65 GLY C A 66 THR N A 66 THR CA A 66 THR C 1.0 -107.0 48.0 PHI 35 35 A 66 THR N A 66 THR CA A 66 THR C A 67 GLN N 1.0 138.0 403.5 PSI 36 36 A 67 GLN C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -119.0 33.0 PHI 37 37 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 GLN N 1.0 143.0 388.5 PSI 38 38 A 68 ARG C A 69 GLN N A 69 GLN CA A 69 GLN C 1.0 -96.0 15.0 PHI 39 39 A 69 GLN N A 69 GLN CA A 69 GLN C A 70 VAL N 1.0 119.0 372.0 PSI 40 40 A 69 GLN C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -93.0 13.5 PHI 41 41 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 THR N 1.0 115.0 400.5 PSI 42 42 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 ILE N 1.0 152.0 387.0 PSI 43 43 A 74 ILE N A 74 ILE CA A 74 ILE C A 75 THR N 1.0 138.0 390.0 PSI 44 44 A 74 ILE C A 75 THR N A 75 THR CA A 75 THR C 1.0 -128.0 15.0 PHI 45 45 A 76 GLN N A 76 GLN CA A 76 GLN C A 77 GLY N 1.0 136.0 378.0 PSI 46 46 A 76 GLN C A 77 GLY N A 77 GLY CA A 77 GLY C 1.0 -122.0 24.0 PHI 47 47 A 77 GLY N A 77 GLY CA A 77 GLY C A 78 ALA N 1.0 137.0 382.5 PSI 48 48 A 78 ALA C A 79 ARG N A 79 ARG CA A 79 ARG C 1.0 -136.0 21.0 PHI 49 49 A 79 ARG N A 79 ARG CA A 79 ARG C A 80 ASP N 1.0 151.0 373.5 PSI 50 50 A 79 ARG C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -111.0 40.5 PHI 51 51 A 82 GLY C A 83 HIS N A 83 HIS CA A 83 HIS C 1.0 -101.0 34.5 PHI 52 52 A 83 HIS N A 83 HIS CA A 83 HIS C A 84 ILE N 1.0 119.0 394.5 PSI 53 53 A 83 HIS C A 84 ILE N A 84 ILE CA A 84 ILE C 1.0 -100.0 27.0 PHI 54 54 A 84 ILE N A 84 ILE CA A 84 ILE C A 85 GLN N 1.0 118.0 384.0 PSI 55 55 A 84 ILE C A 85 GLN N A 85 GLN CA A 85 GLN C 1.0 -123.0 30.0 PHI 56 56 A 85 GLN N A 85 GLN CA A 85 GLN C A 86 TYR N 1.0 152.0 381.0 PSI 57 57 A 86 TYR C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -94.0 34.5 PHI 58 58 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 ALA N 1.0 123.0 387.0 PSI 59 59 A 90 TYR C A 91 LYS N A 91 LYS CA A 91 LYS C 1.0 -122.0 18.0 PHI 60 60 A 91 LYS C A 92 VAL N A 92 VAL CA A 92 VAL C 1.0 -124.0 12.0 PHI 61 61 A 92 VAL C A 93 ALA N A 93 ALA CA A 93 ALA C 1.0 -123.0 13.5 PHI 62 62 A 93 ALA N A 93 ALA CA A 93 ALA C A 94 HIS N 1.0 143.0 384.0 PSI 63 63 A 93 ALA C A 94 HIS N A 94 HIS CA A 94 HIS C 1.0 -127.0 25.5 PHI 64 64 A 94 HIS N A 94 HIS CA A 94 HIS C A 95 SER N 1.0 143.0 378.0 PSI 65 65 A 94 HIS C A 95 SER N A 95 SER CA A 95 SER C 1.0 -125.0 33.0 PHI 66 66 A 96 ASP C A 97 ASP N A 97 ASP CA A 97 ASP C 1.0 -95.0 28.5 PHI 67 67 A 97 ASP N A 97 ASP CA A 97 ASP C A 98 GLY N 1.0 127.0 384.0 PSI 68 68 A 98 GLY C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -100.0 46.5 PHI 69 69 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 GLN N 1.0 139.0 381.0 PSI 70 70 A 99 VAL C A 100 GLN N A 100 GLN CA A 100 GLN C 1.0 -95.0 24.0 PHI 71 71 A 101 TRP C A 102 THR N A 102 THR CA A 102 THR C 1.0 -101.0 18.0 PHI 72 72 A 102 THR C A 103 VAL N A 103 VAL CA A 103 VAL C 1.0 -100.0 12.0 PHI 73 73 A 103 VAL N A 103 VAL CA A 103 VAL C A 104 TYR N 1.0 120.0 381.0 PSI 74 74 A 104 TYR C A 105 GLU N A 105 GLU CA A 105 GLU C 1.0 -119.0 28.5 PHI 75 75 A 105 GLU N A 105 GLU CA A 105 GLU C A 106 GLU N 1.0 142.0 393.0 PSI 76 76 A 108 GLY C A 109 SER N A 109 SER CA A 109 SER C 1.0 -119.0 31.5 PHI 77 77 A 109 SER N A 109 SER CA A 109 SER C A 110 SER N 1.0 146.0 384.0 PSI 78 78 A 110 SER C A 111 LYS N A 111 LYS CA A 111 LYS C 1.0 -99.0 27.0 PHI 79 79 A 111 LYS N A 111 LYS CA A 111 LYS C A 112 VAL N 1.0 129.0 378.0 PSI 80 80 A 111 LYS C A 112 VAL N A 112 VAL CA A 112 VAL C 1.0 -99.0 13.5 PHI 81 81 A 112 VAL N A 112 VAL CA A 112 VAL C A 113 PHE N 1.0 121.0 381.0 PSI 82 82 A 119 ASN C A 120 ASN N A 120 ASN CA A 120 ASN C 1.0 -98.0 21.0 PHI 83 83 A 120 ASN N A 120 ASN CA A 120 ASN C A 121 SER N 1.0 133.0 387.0 PSI 84 84 A 121 SER C A 122 HIS N A 122 HIS CA A 122 HIS C 1.0 -104.0 25.5 PHI 85 85 A 124 LYS N A 124 LYS CA A 124 LYS C A 125 ASN N 1.0 119.0 376.5 PSI 86 86 A 125 ASN N A 125 ASN CA A 125 ASN C A 126 ILE N 1.0 127.0 385.5 PSI 87 87 A 125 ASN C A 126 ILE N A 126 ILE CA A 126 ILE C 1.0 -98.0 21.0 PHI 88 88 A 126 ILE N A 126 ILE CA A 126 ILE C A 127 PHE N 1.0 123.0 372.0 PSI 89 89 A 126 ILE C A 127 PHE N A 127 PHE CA A 127 PHE C 1.0 -96.0 16.5 PHI 90 90 A 131 PHE C A 132 MET N A 132 MET CA A 132 MET C 1.0 -113.0 25.5 PHI 91 91 A 133 ALA N A 133 ALA CA A 133 ALA C A 134 ARG N 1.0 148.0 381.0 PSI 92 92 A 135 TYR C A 136 VAL N A 136 VAL CA A 136 VAL C 1.0 -127.0 21.0 PHI 93 93 A 136 VAL N A 136 VAL CA A 136 VAL C A 137 ARG N 1.0 140.0 384.0 PSI 94 94 A 136 VAL C A 137 ARG N A 137 ARG CA A 137 ARG C 1.0 -125.0 24.0 PHI 95 95 A 137 ARG N A 137 ARG CA A 137 ARG C A 138 VAL N 1.0 136.0 375.0 PSI 96 96 A 137 ARG C A 138 VAL N A 138 VAL CA A 138 VAL C 1.0 -131.0 37.5 PHI 97 97 A 138 VAL N A 138 VAL CA A 138 VAL C A 139 LEU N 1.0 136.0 378.0 PSI 98 98 A 140 PRO N A 140 PRO CA A 140 PRO C A 141 VAL N 1.0 144.0 376.5 PSI 99 99 A 146 ARG C A 147 ILE N A 147 ILE CA A 147 ILE C 1.0 -101.0 22.5 PHI 100 100 A 149 LEU N A 149 LEU CA A 149 LEU C A 150 ARG N 1.0 152.0 376.5 PSI 101 101 A 150 ARG C A 151 LEU N A 151 LEU CA A 151 LEU C 1.0 -121.0 18.0 PHI 102 102 A 151 LEU C A 152 GLU N A 152 GLU CA A 152 GLU C 1.0 -132.0 24.0 PHI 103 103 A 152 GLU N A 152 GLU CA A 152 GLU C A 153 LEU N 1.0 144.0 376.5 PSI 104 104 A 152 GLU C A 153 LEU N A 153 LEU CA A 153 LEU C 1.0 -114.0 18.0 PHI 105 105 A 153 LEU N A 153 LEU CA A 153 LEU C A 154 LEU N 1.0 139.0 385.5 PSI 106 106 A 153 LEU C A 154 LEU N A 154 LEU CA A 154 LEU C 1.0 -121.0 22.5 PHI 107 107 A 154 LEU N A 154 LEU CA A 154 LEU C A 155 GLY N 1.0 150.0 382.5 PSI 108 108 A 155 GLY C A 156 CYS N A 156 CYS CA A 156 CYS C 1.0 -130.0 28.5 PHI 109 109 A 156 CYS N A 156 CYS CA A 156 CYS C A 157 LEU N 1.0 146.0 385.5 PSI 110 110 A 157 LEU N A 157 LEU CA A 157 LEU C A 158 GLU N 1.0 124.0 394.5 PSI stop_ save_